N-[4-[[(3-methyl-1-benzofuran-2-yl)carbonylamino]carbamoyl]phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[4-[[(3-methyl-1-benzofuran-2-yl)carbonylamino]carbamoyl]phenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[4-[[(3-methylbenzofuran-2-carbonyl)amino]carbamoyl]phenyl]-3-nitro-benzenesulfonamide CAS Name: N-[4-[[[(3-methyl-2-benzofuranyl)-oxomethyl]hydrazo]-oxomethyl]phenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[4-[[(3-methyl-1-benzofuran-2-carbonyl)amino]carbamoyl]phenyl]-3-nitrobenzenesulfonamide Traditional Name: N-[4-[[(3-methylbenzofuran-2-carbonyl)amino]carbamoyl]phenyl]-3-nitro-benzenesulfonamide Formula: C23H18N4O7S MolecularWeight: 494.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18N4O7S/c1-14-19-7-2-3-8-20(19)34-21(14)23(29)25-24-22(28)15-9-11-16(12-10-15)26-35(32,33)18-6-4-5-17(13-18)27(30)31/h2-13,26H,1H3,(H,24,28)(H,25,29)