4-[4-[(2-chloranyl-7-methoxy-quinolin-3-yl)methyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-[(2-chloranyl-7-methoxy-quinolin-3-yl)methyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-[(2-chloro-7-methoxy-3-quinolyl)methyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[(2-chloro-7-methoxy-3-quinolinyl)methyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-[(2-chloro-7-methoxyquinolin-3-yl)methyl]piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-[(2-chloro-7-methoxy-3-quinolyl)methyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C21H24ClN5O4S MolecularWeight: 477.96436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CC3=C(N=C4C=C(C=CC4=C3)OC)Cl

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CC3=C(N=C4C=C(C=CC4=C3)OC)Cl

InChI

InChI=1S/C21H24ClN5O4S/c1-25-13-17(11-19(25)21(23)28)32(29,30)27-7-5-26(6-8-27)12-15-9-14-3-4-16(31-2)10-18(14)24-20(15)22/h3-4,9-11,13H,5-8,12H2,1-2H3,(H2,23,28)