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

Systemtic Name: 2-[6-azanyl-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(2,5-dimethylphenyl)propanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-(2,5-dimethylphenyl)propanamide CAS Name: 2-[[6-amino-3,5-dicyano-4-(4-methylphenyl)-2-pyridinyl]thio]-N-(2,5-dimethylphenyl)propanamide IUPAC Name: 2-[6-amino-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(2,5-dimethylphenyl)propanamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]thio]-N-(2,5-dimethylphenyl)propionamide Formula: C25H23N5OS MolecularWeight: 441.54802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SC(C)C(=O)NC3=C(C=CC(=C3)C)C)N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SC(C)C(=O)NC3=C(C=CC(=C3)C)C)N)C#N

InChI

InChI=1S/C25H23N5OS/c1-14-6-9-18(10-7-14)22-19(12-26)23(28)30-25(20(22)13-27)32-17(4)24(31)29-21-11-15(2)5-8-16(21)3/h5-11,17H,1-4H3,(H2,28,30)(H,29,31)