N-butan-2-yl-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]quinoline-8-sulfonamide

Systemtic Name: N-butan-2-yl-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]quinoline-8-sulfonamide Openeye Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-sec-butyl-quinoline-8-sulfonamide CAS Name: N-butan-2-yl-N-[[1-[(3-chlorophenyl)methyl]-2-pyrrolyl]methyl]-8-quinolinesulfonamide IUPAC Name: N-butan-2-yl-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]quinoline-8-sulfonamide Traditional Name: N-[[1-(3-chlorobenzyl)pyrrol-2-yl]methyl]-N-sec-butyl-quinoline-8-sulfonamide Formula: C25H26ClN3O2S MolecularWeight: 468.01084

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=CN1CC2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CCC(C)N(CC1=CC=CN1CC2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C25H26ClN3O2S/c1-3-19(2)29(32(30,31)24-13-5-9-21-10-6-14-27-25(21)24)18-23-12-7-15-28(23)17-20-8-4-11-22(26)16-20/h4-16,19H,3,17-18H2,1-2H3