4-nitro-N-[3-[1-[(4-nitrophenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]benzamide

Systemtic Name: 4-nitro-N-[3-[1-[(4-nitrophenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]benzamide Openeye Name: 4-nitro-N-[3-[1-[(4-nitrophenyl)carbamoyl]propylsulfanyl]phenyl]benzamide CAS Name: 4-nitro-N-[3-[[1-(4-nitroanilino)-1-oxobutan-2-yl]thio]phenyl]benzamide IUPAC Name: 4-nitro-N-[3-[1-(4-nitroanilino)-1-oxobutan-2-yl]sulfanylphenyl]benzamide Traditional Name: 4-nitro-N-[3-[1-[(4-nitrophenyl)carbamoyl]propylthio]phenyl]benzamide Formula: C23H20N4O6S MolecularWeight: 480.4931

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H20N4O6S/c1-2-21(23(29)24-16-8-12-19(13-9-16)27(32)33)34-20-5-3-4-17(14-20)25-22(28)15-6-10-18(11-7-15)26(30)31/h3-14,21H,2H2,1H3,(H,24,29)(H,25,28)