3-nitro-N-[3-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanylphenyl]benzamide

Systemtic Name: 3-nitro-N-[3-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanylphenyl]benzamide Openeye Name: N-[3-[2-(4-isopropylanilino)-2-oxo-ethyl]sulfanylphenyl]-3-nitro-benzamide CAS Name: 3-nitro-N-[3-[[2-oxo-2-(4-propan-2-ylanilino)ethyl]thio]phenyl]benzamide IUPAC Name: 3-nitro-N-[3-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanylphenyl]benzamide Traditional Name: N-[3-[(2-cumidino-2-keto-ethyl)thio]phenyl]-3-nitro-benzamide Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H23N3O4S/c1-16(2)17-9-11-19(12-10-17)25-23(28)15-32-22-8-4-6-20(14-22)26-24(29)18-5-3-7-21(13-18)27(30)31/h3-14,16H,15H2,1-2H3,(H,25,28)(H,26,29)