3-(1-butyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)-N-[(2-methylphenyl)methyl]propanamide

Systemtic Name: 3-(1-butyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)-N-[(2-methylphenyl)methyl]propanamide Openeye Name: 3-(1-butyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)-N-(o-tolylmethyl)propanamide CAS Name: 3-[1-butyl-5-(1-pyrrolidinylsulfonyl)-2-benzimidazolyl]-N-[(2-methylphenyl)methyl]propanamide IUPAC Name: 3-(1-butyl-5-pyrrolidin-1-ylsulfonylbenzimidazol-2-yl)-N-[(2-methylphenyl)methyl]propanamide Traditional Name: 3-(1-butyl-5-pyrrolidinosulfonyl-benzimidazol-2-yl)-N-(2-methylbenzyl)propionamide Formula: C26H34N4O3S MolecularWeight: 482.63816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)NCC4=CC=CC=C4C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)NCC4=CC=CC=C4C

InChI

InChI=1S/C26H34N4O3S/c1-3-4-17-30-24-12-11-22(34(32,33)29-15-7-8-16-29)18-23(24)28-25(30)13-14-26(31)27-19-21-10-6-5-9-20(21)2/h5-6,9-12,18H,3-4,7-8,13-17,19H2,1-2H3,(H,27,31)