(E)-N-[(4-methylphenyl)-(4-oxidanylbutyl)carbamothioyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[(4-methylphenyl)-(4-oxidanylbutyl)carbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[4-hydroxybutyl(p-tolyl)carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[[N-(4-hydroxybutyl)-4-methylanilino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[4-hydroxybutyl-(4-methylphenyl)carbamothioyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[4-hydroxybutyl(p-tolyl)thiocarbamoyl]-3-phenyl-acrylamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCCCO)C(=S)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)N(CCCCO)C(=S)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C21H24N2O2S/c1-17-9-12-19(13-10-17)23(15-5-6-16-24)21(26)22-20(25)14-11-18-7-3-2-4-8-18/h2-4,7-14,24H,5-6,15-16H2,1H3,(H,22,25,26)/b14-11+