2-[6-azanyl-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide

Systemtic Name: 2-[6-azanyl-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-(5-methylisoxazol-3-yl)butanamide CAS Name: 2-[[6-amino-3,5-dicyano-4-(4-methylphenyl)-2-pyridinyl]thio]-N-(5-methyl-3-isoxazolyl)butanamide IUPAC Name: 2-[6-amino-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]thio]-N-(5-methylisoxazol-3-yl)butyramide Formula: C22H20N6O2S MolecularWeight: 432.4982

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NOC(=C1)C)SC2=C(C(=C(C(=N2)N)C#N)C3=CC=C(C=C3)C)C#N

Isomeric SMILES

CCC(C(=O)NC1=NOC(=C1)C)SC2=C(C(=C(C(=N2)N)C#N)C3=CC=C(C=C3)C)C#N

InChI

InChI=1S/C22H20N6O2S/c1-4-17(21(29)26-18-9-13(3)30-28-18)31-22-16(11-24)19(15(10-23)20(25)27-22)14-7-5-12(2)6-8-14/h5-9,17H,4H2,1-3H3,(H2,25,27)(H,26,28,29)