(E)-N-[(3-bromanyl-4-methoxy-phenyl)carbamothioyl]-3-(4-propan-2-ylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[(3-bromanyl-4-methoxy-phenyl)carbamothioyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Openeye Name: (E)-N-[(3-bromo-4-methoxy-phenyl)carbamothioyl]-3-(4-isopropylphenyl)prop-2-enamide CAS Name: (E)-N-[(3-bromo-4-methoxyanilino)-sulfanylidenemethyl]-3-(4-propan-2-ylphenyl)-2-propenamide IUPAC Name: (E)-N-[(3-bromo-4-methoxyphenyl)carbamothioyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Traditional Name: (E)-N-[(3-bromo-4-methoxy-phenyl)thiocarbamoyl]-3-p-cumenyl-acrylamide Formula: C20H21BrN2O2S MolecularWeight: 433.36194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C20H21BrN2O2S/c1-13(2)15-7-4-14(5-8-15)6-11-19(24)23-20(26)22-16-9-10-18(25-3)17(21)12-16/h4-13H,1-3H3,(H2,22,23,24,26)/b11-6+