(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate

Systemtic Name: (2-thiophen-2-yl-1,3-thiazol-4-yl)methyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate Openeye Name: [2-(2-thienyl)thiazol-4-yl]methyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate CAS Name: 3-cyano-6-cyclopropyl-2-(methylthio)-4-pyridinecarboxylic acid (2-thiophen-2-yl-4-thiazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-thiazol-4-yl)methyl 3-cyano-6-cyclopropyl-2-methylsulfanylpyridine-4-carboxylate Traditional Name: 3-cyano-6-cyclopropyl-2-(methylthio)isonicotinic acid [2-(2-thienyl)thiazol-4-yl]methyl ester Formula: C19H15N3O2S3 MolecularWeight: 413.5363

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=CC(=N1)C2CC2)C(=O)OCC3=CSC(=N3)C4=CC=CS4)C#N

Isomeric SMILES

CSC1=C(C(=CC(=N1)C2CC2)C(=O)OCC3=CSC(=N3)C4=CC=CS4)C#N

InChI

InChI=1S/C19H15N3O2S3/c1-25-17-14(8-20)13(7-15(22-17)11-4-5-11)19(23)24-9-12-10-27-18(21-12)16-3-2-6-26-16/h2-3,6-7,10-11H,4-5,9H2,1H3