3-[[(6-chloranylpyridin-3-yl)carbonylamino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide

Systemtic Name: 3-[[(6-chloranylpyridin-3-yl)carbonylamino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide Openeye Name: 3-[[(6-chloropyridine-3-carbonyl)amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide CAS Name: 3-[[[(6-chloro-3-pyridinyl)-oxomethyl]hydrazo]-oxomethyl]-N-(4-methoxyphenyl)benzenesulfonamide IUPAC Name: 3-[[(6-chloropyridine-3-carbonyl)amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide Traditional Name: 3-[[(6-chloronicotinoyl)amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide Formula: C20H17ClN4O5S MolecularWeight: 460.89078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C20H17ClN4O5S/c1-30-16-8-6-15(7-9-16)25-31(28,29)17-4-2-3-13(11-17)19(26)23-24-20(27)14-5-10-18(21)22-12-14/h2-12,25H,1H3,(H,23,26)(H,24,27)