N-(3-methoxypropyl)-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]quinoline-8-sulfonamide

Systemtic Name: N-(3-methoxypropyl)-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]quinoline-8-sulfonamide Openeye Name: N-(3-methoxypropyl)-N-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]quinoline-8-sulfonamide CAS Name: N-(3-methoxypropyl)-N-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-8-quinolinesulfonamide IUPAC Name: N-(3-methoxypropyl)-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]quinoline-8-sulfonamide Traditional Name: N-(3-methoxypropyl)-N-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]quinoline-8-sulfonamide Formula: C26H29N3O3S MolecularWeight: 463.59176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC=C2CN(CCCOC)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC=C2CN(CCCOC)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C26H29N3O3S/c1-21-9-3-4-10-23(21)19-28-16-7-13-24(28)20-29(17-8-18-32-2)33(30,31)25-14-5-11-22-12-6-15-27-26(22)25/h3-7,9-16H,8,17-20H2,1-2H3