CHEBI:107071 - 1-[[(1,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]-3-(2-methoxyphenyl)thiourea

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ChEBI Name 1-[[(1,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]-3-(2-methoxyphenyl)thiourea
ChEBI ID CHEBI:107071
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C14H17N5O2S
Net Charge 0
Average Mass 319.384
Monoisotopic Mass 319.11030
InChI InChI=1S/C14H17N5O2S/c1-9-8-11(18-19(9)2)13(20)16-17-14(22)15-10-6-4-5-7-12(10)21-3/h4-8H,1-3H3,(H,16,20)(H2,15,17,22)
InChIKey AKYGOEVGMSSOLO-UHFFFAOYSA-N
SMILES CC1=CC(=NN1C)C(=O)NNC(=S)NC2=CC=CC=C2OC
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 1-[[(1,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]-3-(2-methoxyphenyl)thiourea (CHEBI:107071) is a methoxybenzenes (CHEBI:51683)
1-[[(1,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]-3-(2-methoxyphenyl)thiourea (CHEBI:107071) is a substituted aniline (CHEBI:48975)
Manual Xref Database
LSM-18425 LINCS
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