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

Systemtic Name: methyl 3-(methylcarbamoyl)-2-(2-phenylsulfanylethanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: methyl 3-(methylcarbamoyl)-2-[(2-phenylsulfanylacetyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-(methylcarbamoyl)-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-(methylcarbamoyl)-2-[(2-phenylsulfanylacetyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 3-(methylcarbamoyl)-2-[[2-(phenylthio)acetyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=C(SC2=C1CCN(C2)C(=O)OC)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

CNC(=O)C1=C(SC2=C1CCN(C2)C(=O)OC)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C19H21N3O4S2/c1-20-17(24)16-13-8-9-22(19(25)26-2)10-14(13)28-18(16)21-15(23)11-27-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H,20,24)(H,21,23)