CHEBI:105653 - 2-[(6-amino-3,5-dicyano-4-thiophen-2-yl-2-pyridinyl)thio]-N-[(2-methoxyphenyl)methyl]acetamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-[(6-amino-3,5-dicyano-4-thiophen-2-yl-2-pyridinyl)thio]-N-[(2-methoxyphenyl)methyl]acetamide
ChEBI ID CHEBI:105653
Stars This entity has been manually annotated by a third party.
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Formula C21H17N5O2S2
Net Charge 0
Average Mass 435.525
Monoisotopic Mass 435.08237
InChI InChI=1S/C21H17N5O2S2/c1-28-16-6-3-2-5-13(16)11-25-18(27)12-30-21-15(10-23)19(17-7-4-8-29-17)14(9-22)20(24)26-21/h2-8H,11-12H2,1H3,(H2,24,26)(H,25,27)
InChIKey KKLGJQYLQBJYML-UHFFFAOYSA-N
SMILES COC1=CC=CC=C1CNC(=O)CSC2=C(C(=C(C(=N2)N)C#N)C3=CC=CS3)C#N
ChEBI Ontology
Outgoing 2-[(6-amino-3,5-dicyano-4-thiophen-2-yl-2-pyridinyl)thio]-N-[(2-methoxyphenyl)methyl]acetamide (CHEBI:105653) is a methoxybenzenes (CHEBI:51683)
Manual Xref Database
LSM-17016 LINCS
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