N-(4-acetamidophenyl)-2-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-acetamidophenyl)-2-[(3-cyano-6-isobutyl-2-pyridyl)sulfanyl]acetamide CAS Name: N-(4-acetamidophenyl)-2-[[3-cyano-6-(2-methylpropyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(4-acetamidophenyl)-2-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-(4-acetamidophenyl)-2-[(3-cyano-6-isobutyl-2-pyridyl)thio]acetamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC(=C(C=C1)C#N)SCC(=O)NC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC(C)CC1=NC(=C(C=C1)C#N)SCC(=O)NC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C20H22N4O2S/c1-13(2)10-18-5-4-15(11-21)20(24-18)27-12-19(26)23-17-8-6-16(7-9-17)22-14(3)25/h4-9,13H,10,12H2,1-3H3,(H,22,25)(H,23,26)