(E)-3-(4-chlorophenyl)-N-[(2,6-dimethylphenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-chlorophenyl)-N-[(2,6-dimethylphenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-chlorophenyl)-N-[(2,6-dimethylphenyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-chlorophenyl)-N-[(2,6-dimethylanilino)-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-chlorophenyl)-N-[(2,6-dimethylphenyl)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(4-chlorophenyl)-N-[(2,6-dimethylphenyl)thiocarbamoyl]acrylamide Formula: C18H17ClN2OS MolecularWeight: 344.85838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)NC(=O)C=CC2=CC=C(C=C2)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClN2OS/c1-12-4-3-5-13(2)17(12)21-18(23)20-16(22)11-8-14-6-9-15(19)10-7-14/h3-11H,1-2H3,(H2,20,21,22,23)/b11-8+