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

Systemtic Name: (E)-N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]-3-(4-methylphenyl)prop-2-enamide Openeye Name: (E)-N-[(4-isopentyloxyphenyl)carbamothioyl]-3-(p-tolyl)prop-2-enamide CAS Name: (E)-N-[[4-(3-methylbutoxy)anilino]-sulfanylidenemethyl]-3-(4-methylphenyl)-2-propenamide IUPAC Name: (E)-N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]-3-(4-methylphenyl)prop-2-enamide Traditional Name: (E)-N-[(4-isoamoxyphenyl)thiocarbamoyl]-3-(p-tolyl)acrylamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O2S/c1-16(2)14-15-26-20-11-9-19(10-12-20)23-22(27)24-21(25)13-8-18-6-4-17(3)5-7-18/h4-13,16H,14-15H2,1-3H3,(H2,23,24,25,27)/b13-8+