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

Systemtic Name: (E)-N-[(3-bromanyl-4-methoxy-phenyl)carbamothioyl]-3-(2,4-dichlorophenyl)prop-2-enamide Openeye Name: (E)-N-[(3-bromo-4-methoxy-phenyl)carbamothioyl]-3-(2,4-dichlorophenyl)prop-2-enamide CAS Name: (E)-N-[(3-bromo-4-methoxyanilino)-sulfanylidenemethyl]-3-(2,4-dichlorophenyl)-2-propenamide IUPAC Name: (E)-N-[(3-bromo-4-methoxyphenyl)carbamothioyl]-3-(2,4-dichlorophenyl)prop-2-enamide Traditional Name: (E)-N-[(3-bromo-4-methoxy-phenyl)thiocarbamoyl]-3-(2,4-dichlorophenyl)acrylamide Formula: C17H13BrCl2N2O2S MolecularWeight: 460.17232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC(=O)C=CC2=C(C=C(C=C2)Cl)Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC(=O)/C=C/C2=C(C=C(C=C2)Cl)Cl)Br

InChI

InChI=1S/C17H13BrCl2N2O2S/c1-24-15-6-5-12(9-13(15)18)21-17(25)22-16(23)7-3-10-2-4-11(19)8-14(10)20/h2-9H,1H3,(H2,21,22,23,25)/b7-3+