2-(3-acetamidophenyl)sulfanyl-N-(3-cyano-6-ethanoyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)propanamide

Systemtic Name: 2-(3-acetamidophenyl)sulfanyl-N-(3-cyano-6-ethanoyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)propanamide Openeye Name: 2-(3-acetamidophenyl)sulfanyl-N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)propanamide CAS Name: 2-[(3-acetamidophenyl)thio]-N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)propanamide IUPAC Name: 2-(3-acetamidophenyl)sulfanyl-N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)propanamide Traditional Name: 2-[(3-acetamidophenyl)thio]-N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)propionamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C2=C(S1)CN(CC2)C(=O)C)C#N)SC3=CC=CC(=C3)NC(=O)C

Isomeric SMILES

CC(C(=O)NC1=C(C2=C(S1)CN(CC2)C(=O)C)C#N)SC3=CC=CC(=C3)NC(=O)C

InChI

InChI=1S/C21H22N4O3S2/c1-12(29-16-6-4-5-15(9-16)23-13(2)26)20(28)24-21-18(10-22)17-7-8-25(14(3)27)11-19(17)30-21/h4-6,9,12H,7-8,11H2,1-3H3,(H,23,26)(H,24,28)