methyl 2-butyl-3-[[4-[2-(prop-2-enylcarbamoylsulfamoyl)phenyl]phenyl]methyl]benzimidazole-4-carboxylate

Systemtic Name: methyl 2-butyl-3-[[4-[2-(prop-2-enylcarbamoylsulfamoyl)phenyl]phenyl]methyl]benzimidazole-4-carboxylate Openeye Name: methyl 3-[[4-[2-(allylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-2-butyl-benzimidazole-4-carboxylate CAS Name: 2-butyl-3-[[4-[2-[[oxo-(prop-2-enylamino)methyl]sulfamoyl]phenyl]phenyl]methyl]-4-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-butyl-3-[[4-[2-(prop-2-enylcarbamoylsulfamoyl)phenyl]phenyl]methyl]benzimidazole-4-carboxylate Traditional Name: 3-[4-[2-(allylcarbamoylsulfamoyl)phenyl]benzyl]-2-butyl-benzimidazole-4-carboxylic acid methyl ester Formula: C30H32N4O5S MolecularWeight: 560.66388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)NC(=O)NCC=C)C(=O)OC

Isomeric SMILES

CCCCC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)NC(=O)NCC=C)C(=O)OC

InChI

InChI=1S/C30H32N4O5S/c1-4-6-14-27-32-25-12-9-11-24(29(35)39-3)28(25)34(27)20-21-15-17-22(18-16-21)23-10-7-8-13-26(23)40(37,38)33-30(36)31-19-5-2/h5,7-13,15-18H,2,4,6,14,19-20H2,1,3H3,(H2,31,33,36)