3-(6-azanyl-3,5-dicyano-4-thiophen-2-yl-pyridin-2-yl)sulfanyl-N-(4-methylphenyl)propanamide

Systemtic Name: 3-(6-azanyl-3,5-dicyano-4-thiophen-2-yl-pyridin-2-yl)sulfanyl-N-(4-methylphenyl)propanamide Openeye Name: 3-[[6-amino-3,5-dicyano-4-(2-thienyl)-2-pyridyl]sulfanyl]-N-(p-tolyl)propanamide CAS Name: 3-[(6-amino-3,5-dicyano-4-thiophen-2-yl-2-pyridinyl)thio]-N-(4-methylphenyl)propanamide IUPAC Name: 3-(6-amino-3,5-dicyano-4-thiophen-2-ylpyridin-2-yl)sulfanyl-N-(4-methylphenyl)propanamide Traditional Name: 3-[[6-amino-3,5-dicyano-4-(2-thienyl)-2-pyridyl]thio]-N-(p-tolyl)propionamide Formula: C21H17N5OS2 MolecularWeight: 419.52258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCSC2=C(C(=C(C(=N2)N)C#N)C3=CC=CS3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCSC2=C(C(=C(C(=N2)N)C#N)C3=CC=CS3)C#N

InChI

InChI=1S/C21H17N5OS2/c1-13-4-6-14(7-5-13)25-18(27)8-10-29-21-16(12-23)19(17-3-2-9-28-17)15(11-22)20(24)26-21/h2-7,9H,8,10H2,1H3,(H2,24,26)(H,25,27)