3-(1-butyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)-N-[(4-fluorophenyl)methyl]propanamide

Systemtic Name: 3-(1-butyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)-N-[(4-fluorophenyl)methyl]propanamide Openeye Name: 3-(1-butyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)-N-[(4-fluorophenyl)methyl]propanamide CAS Name: 3-[1-butyl-5-(1-pyrrolidinylsulfonyl)-2-benzimidazolyl]-N-[(4-fluorophenyl)methyl]propanamide IUPAC Name: 3-(1-butyl-5-pyrrolidin-1-ylsulfonylbenzimidazol-2-yl)-N-[(4-fluorophenyl)methyl]propanamide Traditional Name: 3-(1-butyl-5-pyrrolidinosulfonyl-benzimidazol-2-yl)-N-(4-fluorobenzyl)propionamide Formula: C25H31FN4O3S MolecularWeight: 486.602043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H31FN4O3S/c1-2-3-16-30-23-11-10-21(34(32,33)29-14-4-5-15-29)17-22(23)28-24(30)12-13-25(31)27-18-19-6-8-20(26)9-7-19/h6-11,17H,2-5,12-16,18H2,1H3,(H,27,31)