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

Systemtic Name: 3-[6-azanyl-3,5-dicyano-4-(furan-2-yl)pyridin-2-yl]sulfanyl-N-(4-methylphenyl)propanamide Openeye Name: 3-[[6-amino-3,5-dicyano-4-(2-furyl)-2-pyridyl]sulfanyl]-N-(p-tolyl)propanamide CAS Name: 3-[[6-amino-3,5-dicyano-4-(2-furanyl)-2-pyridinyl]thio]-N-(4-methylphenyl)propanamide IUPAC Name: 3-[6-amino-3,5-dicyano-4-(furan-2-yl)pyridin-2-yl]sulfanyl-N-(4-methylphenyl)propanamide Traditional Name: 3-[[6-amino-3,5-dicyano-4-(2-furyl)-2-pyridyl]thio]-N-(p-tolyl)propionamide Formula: C21H17N5O2S MolecularWeight: 403.45698

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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=CO3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCSC2=C(C(=C(C(=N2)N)C#N)C3=CC=CO3)C#N

InChI

InChI=1S/C21H17N5O2S/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)