2-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-N-(4-phenoxyphenyl)butanamide

Systemtic Name: 2-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-N-(4-phenoxyphenyl)butanamide Openeye Name: 2-[(3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-(4-phenoxyphenyl)butanamide CAS Name: 2-[(3-cyano-6-methyl-2-pyridinyl)thio]-N-(4-phenoxyphenyl)butanamide IUPAC Name: 2-(3-cyano-6-methylpyridin-2-yl)sulfanyl-N-(4-phenoxyphenyl)butanamide Traditional Name: 2-[(3-cyano-6-methyl-2-pyridyl)thio]-N-(4-phenoxyphenyl)butyramide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)SC3=C(C=CC(=N3)C)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)SC3=C(C=CC(=N3)C)C#N

InChI

InChI=1S/C23H21N3O2S/c1-3-21(29-23-17(15-24)10-9-16(2)25-23)22(27)26-18-11-13-20(14-12-18)28-19-7-5-4-6-8-19/h4-14,21H,3H2,1-2H3,(H,26,27)