4-[(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylmethyl]-N-(4-methoxyphenyl)benzamide

Systemtic Name: 4-[(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylmethyl]-N-(4-methoxyphenyl)benzamide Openeye Name: 4-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanylmethyl]-N-(4-methoxyphenyl)benzamide CAS Name: 4-[[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]methyl]-N-(4-methoxyphenyl)benzamide IUPAC Name: 4-[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylmethyl]-N-(4-methoxyphenyl)benzamide Traditional Name: 4-[[(3-cyano-4,6-dimethyl-2-pyridyl)thio]methyl]-N-(4-methoxyphenyl)benzamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC)C

InChI

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