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

Systemtic Name: (E)-N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[(3-isopentyloxyphenyl)carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[[3-(3-methylbutoxy)anilino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[(3-isoamoxyphenyl)thiocarbamoyl]-3-phenyl-acrylamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)NC(=S)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)NC(=S)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C21H24N2O2S/c1-16(2)13-14-25-19-10-6-9-18(15-19)22-21(26)23-20(24)12-11-17-7-4-3-5-8-17/h3-12,15-16H,13-14H2,1-2H3,(H2,22,23,24,26)/b12-11+