2-[3-cyano-6-phenyl-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N-(3-methylpyridin-2-yl)butanamide

Systemtic Name: 2-[3-cyano-6-phenyl-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N-(3-methylpyridin-2-yl)butanamide Openeye Name: 2-[[3-cyano-6-phenyl-4-(3,4,5-trimethoxyphenyl)-2-pyridyl]sulfanyl]-N-(3-methyl-2-pyridyl)butanamide CAS Name: 2-[[3-cyano-6-phenyl-4-(3,4,5-trimethoxyphenyl)-2-pyridinyl]thio]-N-(3-methyl-2-pyridinyl)butanamide IUPAC Name: 2-[3-cyano-6-phenyl-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N-(3-methylpyridin-2-yl)butanamide Traditional Name: 2-[[3-cyano-6-phenyl-4-(3,4,5-trimethoxyphenyl)-2-pyridyl]thio]-N-(3-methyl-2-pyridyl)butyramide Formula: C31H30N4O4S MolecularWeight: 554.6593

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC=N1)C)SC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC(=C(C(=C4)OC)OC)OC)C#N

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC=N1)C)SC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC(=C(C(=C4)OC)OC)OC)C#N

InChI

InChI=1S/C31H30N4O4S/c1-6-27(30(36)35-29-19(2)11-10-14-33-29)40-31-23(18-32)22(17-24(34-31)20-12-8-7-9-13-20)21-15-25(37-3)28(39-5)26(16-21)38-4/h7-17,27H,6H2,1-5H3,(H,33,35,36)