(E)-3-(2-chlorophenyl)-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(2-chlorophenyl)-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(2-chlorophenyl)-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(2-chlorophenyl)-N-[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(2-chlorophenyl)-N-[(4-methoxy-2-nitrophenyl)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(2-chlorophenyl)-N-[(4-methoxy-2-nitro-phenyl)thiocarbamoyl]acrylamide Formula: C17H14ClN3O4S MolecularWeight: 391.82876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=S)NC(=O)C=CC2=CC=CC=C2Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=S)NC(=O)/C=C/C2=CC=CC=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN3O4S/c1-25-12-7-8-14(15(10-12)21(23)24)19-17(26)20-16(22)9-6-11-4-2-3-5-13(11)18/h2-10H,1H3,(H2,19,20,22,26)/b9-6+