(E)-N-[2-(cyclohexen-1-yl)ethyl-(4-oxidanylbutyl)carbamothioyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[2-(cyclohexen-1-yl)ethyl-(4-oxidanylbutyl)carbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[2-(cyclohexen-1-yl)ethyl-(4-hydroxybutyl)carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[[2-(1-cyclohexenyl)ethyl-(4-hydroxybutyl)amino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[2-(cyclohexen-1-yl)ethyl-(4-hydroxybutyl)carbamothioyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[2-(cyclohexen-1-yl)ethyl-(4-hydroxybutyl)thiocarbamoyl]-3-phenyl-acrylamide Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCN(CCCCO)C(=S)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

C1CCC(=CC1)CCN(CCCCO)C(=S)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C22H30N2O2S/c25-18-8-7-16-24(17-15-20-11-5-2-6-12-20)22(27)23-21(26)14-13-19-9-3-1-4-10-19/h1,3-4,9-11,13-14,25H,2,5-8,12,15-18H2,(H,23,26,27)/b14-13+