(E)-N-[cyclobutylmethyl-(phenylmethyl)carbamothioyl]-3-(4-methylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[cyclobutylmethyl-(phenylmethyl)carbamothioyl]-3-(4-methylphenyl)prop-2-enamide Openeye Name: (E)-N-[benzyl(cyclobutylmethyl)carbamothioyl]-3-(p-tolyl)prop-2-enamide CAS Name: (E)-N-[[cyclobutylmethyl-(phenylmethyl)amino]-sulfanylidenemethyl]-3-(4-methylphenyl)-2-propenamide IUPAC Name: (E)-N-[benzyl(cyclobutylmethyl)carbamothioyl]-3-(4-methylphenyl)prop-2-enamide Traditional Name: (E)-N-[benzyl(cyclobutylmethyl)thiocarbamoyl]-3-(p-tolyl)acrylamide Formula: C23H26N2OS MolecularWeight: 378.53034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)NC(=S)N(CC2CCC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)NC(=S)N(CC2CCC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H26N2OS/c1-18-10-12-19(13-11-18)14-15-22(26)24-23(27)25(17-21-8-5-9-21)16-20-6-3-2-4-7-20/h2-4,6-7,10-15,21H,5,8-9,16-17H2,1H3,(H,24,26,27)/b15-14+