nizatidine (CHEBI:7601)

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ChEBI Name	nizatidine

ChEBI ID	CHEBI:7601

Definition	A member of the class of 1,3-thiazoles having a dimethylaminomethyl substituent at position 2 and an alkylthiomethyl moiety at position 4.

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C12H21N5O2S2

Net Charge

Average Mass

331.45700

Monoisotopic Mass

331.11367

InChI

InChI=1S/C12H21N5O2S2/c1-13-11(6-17(18)19)14-4-5-20-8-10-9-21-12(15-10)7-16(2)3/h6,9,13-14H,4-5,7-8H2,1-3H3

InChIKey

SGXXNSQHWDMGGP-UHFFFAOYSA-N

SMILES

CNC(NCCSCc1csc(CN(C)C)n1)=C[N+]([O-])=O

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	H2-receptor antagonist H2-receptor antagonists are the drugs that selectively bind to but do not activate histamine H2 receptors, thereby blocking the actions of endogenous histamine. cholinergic drug Any drug used for its actions on cholinergic systems. Included here are agonists and antagonists, drugs that affect the life cycle of acetylcholine, and drugs that affect the survival of cholinergic neurons.

Application(s):	anti-ulcer drug One of various classes of drugs with different action mechanisms used to treat or ameliorate peptic ulcer or irritation of the gastrointestinal tract. H2-receptor antagonist H2-receptor antagonists are the drugs that selectively bind to but do not activate histamine H2 receptors, thereby blocking the actions of endogenous histamine. cholinergic drug Any drug used for its actions on cholinergic systems. Included here are agonists and antagonists, drugs that affect the life cycle of acetylcholine, and drugs that affect the survival of cholinergic neurons.

ChEBI Ontology
Outgoing	nizatidine (CHEBI:7601) has role anti-ulcer drug (CHEBI:49201) nizatidine (CHEBI:7601) has role cholinergic drug (CHEBI:38323) nizatidine (CHEBI:7601) has role H₂-receptor antagonist (CHEBI:37961) nizatidine (CHEBI:7601) is a 1,3-thiazoles (CHEBI:38418) nizatidine (CHEBI:7601) is a C-nitro compound (CHEBI:35716) nizatidine (CHEBI:7601) is a carboxamidine (CHEBI:35359) nizatidine (CHEBI:7601) is a organic sulfide (CHEBI:16385) nizatidine (CHEBI:7601) is a tertiary amino compound (CHEBI:50996)

IUPAC Name

N-{2-[({2-[(dimethylamino)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]ethyl}-Nʼ-methyl-2-nitroethene-1,1-diamine

Synonym	Source
N-(4-(6-Methylamino-7-nitro-2-thia-5-aza-6-hepten-1-yl)-2-thiazolylmethyl)-N,N-dimethylamine	ChemIDplus

Last Modified

22 February 2017