N-[(4-nitro-2-oxidanyl-phenyl)carbamothioyl]-4-phenyl-benzamide

Systemtic Name: N-[(4-nitro-2-oxidanyl-phenyl)carbamothioyl]-4-phenyl-benzamide Openeye Name: N-[(2-hydroxy-4-nitro-phenyl)carbamothioyl]-4-phenyl-benzamide CAS Name: N-[(2-hydroxy-4-nitroanilino)-sulfanylidenemethyl]-4-phenylbenzamide IUPAC Name: N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-4-phenylbenzamide Traditional Name: N-[(2-hydroxy-4-nitro-phenyl)thiocarbamoyl]-4-phenyl-benzamide Formula: C20H15N3O4S MolecularWeight: 393.4158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15N3O4S/c24-18-12-16(23(26)27)10-11-17(18)21-20(28)22-19(25)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12,24H,(H2,21,22,25,28)