(E)-N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Openeye Name: (E)-N-[(2-hydroxy-5-nitro-phenyl)carbamothioyl]-3-(5-phenyl-2-furyl)prop-2-enamide CAS Name: (E)-N-[(2-hydroxy-5-nitroanilino)-sulfanylidenemethyl]-3-(5-phenyl-2-furanyl)-2-propenamide IUPAC Name: (E)-N-[(2-hydroxy-5-nitrophenyl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Traditional Name: (E)-N-[(2-hydroxy-5-nitro-phenyl)thiocarbamoyl]-3-(5-phenyl-2-furyl)acrylamide Formula: C20H15N3O5S MolecularWeight: 409.4152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(O2)C=CC(=O)NC(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(O2)/C=C/C(=O)NC(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C20H15N3O5S/c24-17-9-6-14(23(26)27)12-16(17)21-20(29)22-19(25)11-8-15-7-10-18(28-15)13-4-2-1-3-5-13/h1-12,24H,(H2,21,22,25,29)/b11-8+