3-nitro-N-[3-(2-oxidanylidene-1-phenyl-2-phenylazanyl-ethyl)sulfanylphenyl]benzamide

Systemtic Name: 3-nitro-N-[3-(2-oxidanylidene-1-phenyl-2-phenylazanyl-ethyl)sulfanylphenyl]benzamide Openeye Name: N-[3-(2-anilino-2-oxo-1-phenyl-ethyl)sulfanylphenyl]-3-nitro-benzamide CAS Name: N-[3-[(2-anilino-2-oxo-1-phenylethyl)thio]phenyl]-3-nitrobenzamide IUPAC Name: N-[3-(2-anilino-2-oxo-1-phenylethyl)sulfanylphenyl]-3-nitrobenzamide Traditional Name: N-[3-[(2-anilino-2-keto-1-phenyl-ethyl)thio]phenyl]-3-nitro-benzamide Formula: C27H21N3O4S MolecularWeight: 483.53834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H21N3O4S/c31-26(20-11-7-15-23(17-20)30(33)34)29-22-14-8-16-24(18-22)35-25(19-9-3-1-4-10-19)27(32)28-21-12-5-2-6-13-21/h1-18,25H,(H,28,32)(H,29,31)