[4-[(4-chloranyl-3-methyl-phenyl)sulfonyl-pyridin-4-ylcarbonyl-amino]phenyl] pyridine-4-carboxylate

Systemtic Name: [4-[(4-chloranyl-3-methyl-phenyl)sulfonyl-pyridin-4-ylcarbonyl-amino]phenyl] pyridine-4-carboxylate Openeye Name: [4-[(4-chloro-3-methyl-phenyl)sulfonyl-(pyridine-4-carbonyl)amino]phenyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [4-[(4-chloro-3-methylphenyl)sulfonyl-[oxo(pyridin-4-yl)methyl]amino]phenyl] ester IUPAC Name: [4-[(4-chloro-3-methylphenyl)sulfonyl-(pyridine-4-carbonyl)amino]phenyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [4-[(4-chloro-3-methyl-phenyl)sulfonyl-isonicotinoyl-amino]phenyl] ester Formula: C25H18ClN3O5S MolecularWeight: 507.94552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N(C2=CC=C(C=C2)OC(=O)C3=CC=NC=C3)C(=O)C4=CC=NC=C4)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N(C2=CC=C(C=C2)OC(=O)C3=CC=NC=C3)C(=O)C4=CC=NC=C4)Cl

InChI

InChI=1S/C25H18ClN3O5S/c1-17-16-22(6-7-23(17)26)35(32,33)29(24(30)18-8-12-27-13-9-18)20-2-4-21(5-3-20)34-25(31)19-10-14-28-15-11-19/h2-16H,1H3