(E)-3-[2-(2,2-dimethylpropylsulfanyl)pyridin-3-yl]-N-(3-oxidanylcyclohexyl)prop-2-enamide

Systemtic Name: (E)-3-[2-(2,2-dimethylpropylsulfanyl)pyridin-3-yl]-N-(3-oxidanylcyclohexyl)prop-2-enamide Openeye Name: (E)-3-[2-(2,2-dimethylpropylsulfanyl)-3-pyridyl]-N-(3-hydroxycyclohexyl)prop-2-enamide CAS Name: (E)-3-[2-(2,2-dimethylpropylthio)-3-pyridinyl]-N-(3-hydroxycyclohexyl)-2-propenamide IUPAC Name: (E)-3-[2-(2,2-dimethylpropylsulfanyl)pyridin-3-yl]-N-(3-hydroxycyclohexyl)prop-2-enamide Traditional Name: (E)-N-(3-hydroxycyclohexyl)-3-[2-(neopentylthio)-3-pyridyl]acrylamide Formula: C19H28N2O2S MolecularWeight: 348.50282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CSC1=C(C=CC=N1)C=CC(=O)NC2CCCC(C2)O

Isomeric SMILES

CC(C)(C)CSC1=C(C=CC=N1)/C=C/C(=O)NC2CCCC(C2)O

InChI

InChI=1S/C19H28N2O2S/c1-19(2,3)13-24-18-14(6-5-11-20-18)9-10-17(23)21-15-7-4-8-16(22)12-15/h5-6,9-11,15-16,22H,4,7-8,12-13H2,1-3H3,(H,21,23)/b10-9+