methyl 3-cyano-2-(2-phenylsulfanylethanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: methyl 3-cyano-2-(2-phenylsulfanylethanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: methyl 3-cyano-2-[(2-phenylsulfanylacetyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-cyano-2-[[1-oxo-2-(phenylthio)ethyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester IUPAC Name: methyl 3-cyano-2-[(2-phenylsulfanylacetyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 3-cyano-2-[[2-(phenylthio)acetyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC2=C(C1)SC(=C2C#N)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

COC(=O)N1CCC2=C(C1)SC(=C2C#N)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C18H17N3O3S2/c1-24-18(23)21-8-7-13-14(9-19)17(26-15(13)10-21)20-16(22)11-25-12-5-3-2-4-6-12/h2-6H,7-8,10-11H2,1H3,(H,20,22)