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

Systemtic Name: (E)-3-(4-nitrophenyl)-N-[(phenylmethyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-N-(benzylcarbamothioyl)-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-3-(4-nitrophenyl)-N-[[(phenylmethyl)amino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-N-(benzylcarbamothioyl)-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(benzylthiocarbamoyl)-3-(4-nitrophenyl)acrylamide Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O3S/c21-16(11-8-13-6-9-15(10-7-13)20(22)23)19-17(24)18-12-14-4-2-1-3-5-14/h1-11H,12H2,(H2,18,19,21,24)/b11-8+