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

Systemtic Name: 4-nitro-N-[3-(2-oxidanylidene-1-phenyl-2-phenylazanyl-ethyl)sulfanylphenyl]benzamide Openeye Name: N-[3-(2-anilino-2-oxo-1-phenyl-ethyl)sulfanylphenyl]-4-nitro-benzamide CAS Name: N-[3-[(2-anilino-2-oxo-1-phenylethyl)thio]phenyl]-4-nitrobenzamide IUPAC Name: N-[3-(2-anilino-2-oxo-1-phenylethyl)sulfanylphenyl]-4-nitrobenzamide Traditional Name: N-[3-[(2-anilino-2-keto-1-phenyl-ethyl)thio]phenyl]-4-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=C(C=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=C(C=C4)[N+](=O)[O-]

InChI

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