(E)-3-(2,4-dichlorophenyl)-N-[(4-nitrophenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(2,4-dichlorophenyl)-N-[(4-nitrophenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(2,4-dichlorophenyl)-N-[(4-nitrophenyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(2,4-dichlorophenyl)-N-[(4-nitroanilino)-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(2,4-dichlorophenyl)-N-[(4-nitrophenyl)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(2,4-dichlorophenyl)-N-[(4-nitrophenyl)thiocarbamoyl]acrylamide Formula: C16H11Cl2N3O3S MolecularWeight: 396.24784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC(=O)C=CC2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC(=O)/C=C/C2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H11Cl2N3O3S/c17-11-3-1-10(14(18)9-11)2-8-15(22)20-16(25)19-12-4-6-13(7-5-12)21(23)24/h1-9H,(H2,19,20,22,25)/b8-2+