3-chloranyl-4-fluoranyl-N-[[4-[(pyridin-3-ylcarbonylamino)carbamoyl]phenyl]methyl]benzenesulfonamide

Systemtic Name: 3-chloranyl-4-fluoranyl-N-[[4-[(pyridin-3-ylcarbonylamino)carbamoyl]phenyl]methyl]benzenesulfonamide Openeye Name: 3-chloro-4-fluoro-N-[[4-[(pyridine-3-carbonylamino)carbamoyl]phenyl]methyl]benzenesulfonamide CAS Name: 3-chloro-4-fluoro-N-[[4-[oxo-[[oxo(3-pyridinyl)methyl]hydrazo]methyl]phenyl]methyl]benzenesulfonamide IUPAC Name: 3-chloro-4-fluoro-N-[[4-[(pyridine-3-carbonylamino)carbamoyl]phenyl]methyl]benzenesulfonamide Traditional Name: 3-chloro-4-fluoro-N-[4-(nicotinamidocarbamoyl)benzyl]benzenesulfonamide Formula: C20H16ClFN4O4S MolecularWeight: 462.881843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16ClFN4O4S/c21-17-10-16(7-8-18(17)22)31(29,30)24-11-13-3-5-14(6-4-13)19(27)25-26-20(28)15-2-1-9-23-12-15/h1-10,12,24H,11H2,(H,25,27)(H,26,28)