N,N-diethyl-1-methyl-5-[4-(quinolin-8-ylmethyl)piperazin-1-yl]carbonyl-pyrrole-3-sulfonamide

Systemtic Name: N,N-diethyl-1-methyl-5-[4-(quinolin-8-ylmethyl)piperazin-1-yl]carbonyl-pyrrole-3-sulfonamide Openeye Name: N,N-diethyl-1-methyl-5-[4-(8-quinolylmethyl)piperazine-1-carbonyl]pyrrole-3-sulfonamide CAS Name: N,N-diethyl-1-methyl-5-[oxo-[4-(8-quinolinylmethyl)-1-piperazinyl]methyl]-3-pyrrolesulfonamide IUPAC Name: N,N-diethyl-1-methyl-5-[4-(quinolin-8-ylmethyl)piperazine-1-carbonyl]pyrrole-3-sulfonamide Traditional Name: N,N-diethyl-1-methyl-5-[4-(8-quinolylmethyl)piperazine-1-carbonyl]pyrrole-3-sulfonamide Formula: C24H31N5O3S MolecularWeight: 469.59964

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)N2CCN(CC2)CC3=CC=CC4=C3N=CC=C4)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)N2CCN(CC2)CC3=CC=CC4=C3N=CC=C4)C

InChI

InChI=1S/C24H31N5O3S/c1-4-29(5-2)33(31,32)21-16-22(26(3)18-21)24(30)28-14-12-27(13-15-28)17-20-9-6-8-19-10-7-11-25-23(19)20/h6-11,16,18H,4-5,12-15,17H2,1-3H3