2-chloranyl-N-(phenylmethyl)-5-[(pyridin-3-ylcarbonylamino)carbamoyl]benzenesulfonamide

Systemtic Name: 2-chloranyl-N-(phenylmethyl)-5-[(pyridin-3-ylcarbonylamino)carbamoyl]benzenesulfonamide Openeye Name: N-benzyl-2-chloro-5-[(pyridine-3-carbonylamino)carbamoyl]benzenesulfonamide CAS Name: 2-chloro-5-[oxo-[[oxo(3-pyridinyl)methyl]hydrazo]methyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-2-chloro-5-[(pyridine-3-carbonylamino)carbamoyl]benzenesulfonamide Traditional Name: N-benzyl-2-chloro-5-(nicotinamidocarbamoyl)benzenesulfonamide Formula: C20H17ClN4O4S MolecularWeight: 444.89138

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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=CN=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)NNC(=O)C3=CN=CC=C3)Cl

InChI

InChI=1S/C20H17ClN4O4S/c21-17-9-8-15(19(26)24-25-20(27)16-7-4-10-22-13-16)11-18(17)30(28,29)23-12-14-5-2-1-3-6-14/h1-11,13,23H,12H2,(H,24,26)(H,25,27)