(E)-3-[2-(4-methylphenyl)sulfanylpyridin-3-yl]-N-(4-oxidanylcyclohexyl)prop-2-enamide

Systemtic Name: (E)-3-[2-(4-methylphenyl)sulfanylpyridin-3-yl]-N-(4-oxidanylcyclohexyl)prop-2-enamide Openeye Name: (E)-N-(4-hydroxycyclohexyl)-3-[2-(p-tolylsulfanyl)-3-pyridyl]prop-2-enamide CAS Name: (E)-N-(4-hydroxycyclohexyl)-3-[2-[(4-methylphenyl)thio]-3-pyridinyl]-2-propenamide IUPAC Name: (E)-N-(4-hydroxycyclohexyl)-3-[2-(4-methylphenyl)sulfanylpyridin-3-yl]prop-2-enamide Traditional Name: (E)-N-(4-hydroxycyclohexyl)-3-[2-(p-tolylthio)-3-pyridyl]acrylamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=CC=N2)C=CC(=O)NC3CCC(CC3)O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=CC=N2)/C=C/C(=O)NC3CCC(CC3)O

InChI

InChI=1S/C21H24N2O2S/c1-15-4-11-19(12-5-15)26-21-16(3-2-14-22-21)6-13-20(25)23-17-7-9-18(24)10-8-17/h2-6,11-14,17-18,24H,7-10H2,1H3,(H,23,25)/b13-6+