(E)-3-[2-(4-chlorophenyl)sulfanyl-6-methyl-pyridin-3-yl]-N-(4-oxidanylcyclohexyl)prop-2-enamide

Systemtic Name: (E)-3-[2-(4-chlorophenyl)sulfanyl-6-methyl-pyridin-3-yl]-N-(4-oxidanylcyclohexyl)prop-2-enamide Openeye Name: (E)-3-[2-(4-chlorophenyl)sulfanyl-6-methyl-3-pyridyl]-N-(4-hydroxycyclohexyl)prop-2-enamide CAS Name: (E)-3-[2-[(4-chlorophenyl)thio]-6-methyl-3-pyridinyl]-N-(4-hydroxycyclohexyl)-2-propenamide IUPAC Name: (E)-3-[2-(4-chlorophenyl)sulfanyl-6-methylpyridin-3-yl]-N-(4-hydroxycyclohexyl)prop-2-enamide Traditional Name: (E)-3-[2-[(4-chlorophenyl)thio]-6-methyl-3-pyridyl]-N-(4-hydroxycyclohexyl)acrylamide Formula: C21H23ClN2O2S MolecularWeight: 402.93752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C=CC(=O)NC2CCC(CC2)O)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NC(=C(C=C1)/C=C/C(=O)NC2CCC(CC2)O)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN2O2S/c1-14-2-3-15(21(23-14)27-19-11-5-16(22)6-12-19)4-13-20(26)24-17-7-9-18(25)10-8-17/h2-6,11-13,17-18,25H,7-10H2,1H3,(H,24,26)/b13-4+