2-methyl-N-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoline-8-sulfonamide

Systemtic Name: 2-methyl-N-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoline-8-sulfonamide Openeye Name: 2-methyl-N-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoline-8-sulfonamide CAS Name: 2-methyl-N-[2-(4-methyl-1-piperazinyl)-2-(1-methyl-2-pyrrolyl)ethyl]-8-quinolinesulfonamide IUPAC Name: 2-methyl-N-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoline-8-sulfonamide Traditional Name: 2-methyl-N-[2-(4-methylpiperazino)-2-(1-methylpyrrol-2-yl)ethyl]quinoline-8-sulfonamide Formula: C22H29N5O2S MolecularWeight: 427.56296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2S(=O)(=O)NCC(C3=CC=CN3C)N4CCN(CC4)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2S(=O)(=O)NCC(C3=CC=CN3C)N4CCN(CC4)C)C=C1

InChI

InChI=1S/C22H29N5O2S/c1-17-9-10-18-6-4-8-21(22(18)24-17)30(28,29)23-16-20(19-7-5-11-26(19)3)27-14-12-25(2)13-15-27/h4-11,20,23H,12-16H2,1-3H3