1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(6-chloranylquinolin-8-yl)piperidine-4-carboxamide

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(6-chloranylquinolin-8-yl)piperidine-4-carboxamide Openeye Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(6-chloro-8-quinolyl)piperidine-4-carboxamide CAS Name: 1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-N-(6-chloro-8-quinolinyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonyl-N-(6-chloroquinolin-8-yl)piperidine-4-carboxamide Traditional Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(6-chloro-8-quinolyl)isonipecotamide Formula: C21H22ClN5O4S MolecularWeight: 475.94848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C4C(=CC(=C3)Cl)C=CC=N4

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C4C(=CC(=C3)Cl)C=CC=N4

InChI

InChI=1S/C21H22ClN5O4S/c1-26-12-16(11-18(26)20(23)28)32(30,31)27-7-4-13(5-8-27)21(29)25-17-10-15(22)9-14-3-2-6-24-19(14)17/h2-3,6,9-13H,4-5,7-8H2,1H3,(H2,23,28)(H,25,29)