N-[3-chloranyl-4-[(3-methylsulfonylphenyl)carbonylamino]phenyl]-2-sulfanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[3-chloranyl-4-[(3-methylsulfonylphenyl)carbonylamino]phenyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[3-chloro-4-[(3-methylsulfonylbenzoyl)amino]phenyl]-2-thioxo-1H-pyridine-3-carboxamide CAS Name: N-[3-chloro-4-[[(3-methylsulfonylphenyl)-oxomethyl]amino]phenyl]-2-sulfanylidene-1H-pyridine-3-carboxamide IUPAC Name: N-[3-chloro-4-[(3-methylsulfonylbenzoyl)amino]phenyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Traditional Name: N-[3-chloro-4-[(3-mesylbenzoyl)amino]phenyl]-2-thioxo-1H-pyridine-3-carboxamide Formula: C20H16ClN3O4S2 MolecularWeight: 461.94174

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)C3=CC=CNC3=S)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)C3=CC=CNC3=S)Cl

InChI

InChI=1S/C20H16ClN3O4S2/c1-30(27,28)14-5-2-4-12(10-14)18(25)24-17-8-7-13(11-16(17)21)23-19(26)15-6-3-9-22-20(15)29/h2-11H,1H3,(H,22,29)(H,23,26)(H,24,25)