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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC(=CC=C2)OCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC(=CC=C2)OCC(C)C

InChI

InChI=1S/C21H24N2O2S/c1-15(2)14-25-19-6-4-5-18(13-19)22-21(26)23-20(24)12-11-17-9-7-16(3)8-10-17/h4-13,15H,14H2,1-3H3,(H2,22,23,24,26)/b12-11+