N-[[2-(methylsulfonylamino)phenyl]methyl]-3-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)propanamide

Systemtic Name: N-[[2-(methylsulfonylamino)phenyl]methyl]-3-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)propanamide Openeye Name: N-[[2-(methanesulfonamido)phenyl]methyl]-3-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)propanamide CAS Name: N-[[2-(methanesulfonamido)phenyl]methyl]-3-(1-propyl-5-sulfamoyl-2-benzimidazolyl)propanamide IUPAC Name: N-[[2-(methanesulfonamido)phenyl]methyl]-3-(1-propyl-5-sulfamoylbenzimidazol-2-yl)propanamide Traditional Name: N-[2-(methanesulfonamido)benzyl]-3-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)propionamide Formula: C21H27N5O5S2 MolecularWeight: 493.59958

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CCC(=O)NCC3=CC=CC=C3NS(=O)(=O)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CCC(=O)NCC3=CC=CC=C3NS(=O)(=O)C

InChI

InChI=1S/C21H27N5O5S2/c1-3-12-26-19-9-8-16(33(22,30)31)13-18(19)24-20(26)10-11-21(27)23-14-15-6-4-5-7-17(15)25-32(2,28)29/h4-9,13,25H,3,10-12,14H2,1-2H3,(H,23,27)(H2,22,30,31)