(E)-3-(3-nitrophenyl)-N-[(3-phenylmethoxyphenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(3-nitrophenyl)-N-[(3-phenylmethoxyphenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-N-[(3-benzyloxyphenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-3-(3-nitrophenyl)-N-[(3-phenylmethoxyanilino)-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(3-nitrophenyl)-N-[(3-phenylmethoxyphenyl)carbamothioyl]prop-2-enamide Traditional Name: (E)-N-[(3-benzoxyphenyl)thiocarbamoyl]-3-(3-nitrophenyl)acrylamide Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)NC(=S)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)NC(=S)NC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H19N3O4S/c27-22(13-12-17-8-4-10-20(14-17)26(28)29)25-23(31)24-19-9-5-11-21(15-19)30-16-18-6-2-1-3-7-18/h1-15H,16H2,(H2,24,25,27,31)/b13-12+