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

Systemtic Name: N-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoline-8-sulfonamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoline-8-sulfonamide CAS Name: N-[2-(4-methyl-1-piperazinyl)-2-(1-methyl-2-pyrrolyl)ethyl]-8-quinolinesulfonamide IUPAC Name: N-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]quinoline-8-sulfonamide Traditional Name: N-[2-(4-methylpiperazino)-2-(1-methylpyrrol-2-yl)ethyl]quinoline-8-sulfonamide Formula: C21H27N5O2S MolecularWeight: 413.53638

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CNS(=O)(=O)C2=CC=CC3=C2N=CC=C3)C4=CC=CN4C

Isomeric SMILES

CN1CCN(CC1)C(CNS(=O)(=O)C2=CC=CC3=C2N=CC=C3)C4=CC=CN4C

InChI

InChI=1S/C21H27N5O2S/c1-24-12-14-26(15-13-24)19(18-8-5-11-25(18)2)16-23-29(27,28)20-9-3-6-17-7-4-10-22-21(17)20/h3-11,19,23H,12-16H2,1-2H3