2-chloranyl-5-[[(3-nitrophenyl)carbonylamino]carbamoyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 2-chloranyl-5-[[(3-nitrophenyl)carbonylamino]carbamoyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-2-chloro-5-[[(3-nitrobenzoyl)amino]carbamoyl]benzenesulfonamide CAS Name: 2-chloro-5-[[[(3-nitrophenyl)-oxomethyl]hydrazo]-oxomethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-2-chloro-5-[[(3-nitrobenzoyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N-benzyl-2-chloro-5-[[(3-nitrobenzoyl)amino]carbamoyl]benzenesulfonamide Formula: C21H17ClN4O6S MolecularWeight: 488.90088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H17ClN4O6S/c22-18-10-9-16(12-19(18)33(31,32)23-13-14-5-2-1-3-6-14)21(28)25-24-20(27)15-7-4-8-17(11-15)26(29)30/h1-12,23H,13H2,(H,24,27)(H,25,28)