4-[4-[(2-chloranylquinolin-3-yl)methyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-[(2-chloranylquinolin-3-yl)methyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-[(2-chloro-3-quinolyl)methyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[(2-chloro-3-quinolinyl)methyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-[(2-chloroquinolin-3-yl)methyl]piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-[(2-chloro-3-quinolyl)methyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C20H22ClN5O3S MolecularWeight: 447.93838

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CC3=CC4=CC=CC=C4N=C3Cl

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CC3=CC4=CC=CC=C4N=C3Cl

InChI

InChI=1S/C20H22ClN5O3S/c1-24-13-16(11-18(24)20(22)27)30(28,29)26-8-6-25(7-9-26)12-15-10-14-4-2-3-5-17(14)23-19(15)21/h2-5,10-11,13H,6-9,12H2,1H3,(H2,22,27)