ethyl 4-[2-[3-[(3-nitrophenyl)carbonylamino]phenyl]sulfanylethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[3-[(3-nitrophenyl)carbonylamino]phenyl]sulfanylethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[3-[(3-nitrobenzoyl)amino]phenyl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[[3-[[(3-nitrophenyl)-oxomethyl]amino]phenyl]thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[3-[(3-nitrobenzoyl)amino]phenyl]sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[[3-[(3-nitrobenzoyl)amino]phenyl]thio]acetyl]amino]benzoic acid ethyl ester Formula: C24H21N3O6S MolecularWeight: 479.50504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21N3O6S/c1-2-33-24(30)16-9-11-18(12-10-16)25-22(28)15-34-21-8-4-6-19(14-21)26-23(29)17-5-3-7-20(13-17)27(31)32/h3-14H,2,15H2,1H3,(H,25,28)(H,26,29)