[5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 4-pyrazol-1-ylbenzoate

Systemtic Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 4-pyrazol-1-ylbenzoate Openeye Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 4-pyrazol-1-ylbenzoate CAS Name: 4-(1-pyrazolyl)benzoic acid [5-(dimethylsulfamoyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: [5-(dimethylsulfamoyl)-1-propylbenzimidazol-2-yl]methyl 4-pyrazol-1-ylbenzoate Traditional Name: 4-pyrazol-1-ylbenzoic acid [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl ester Formula: C23H25N5O4S MolecularWeight: 467.5407

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C23H25N5O4S/c1-4-13-27-21-11-10-19(33(30,31)26(2)3)15-20(21)25-22(27)16-32-23(29)17-6-8-18(9-7-17)28-14-5-12-24-28/h5-12,14-15H,4,13,16H2,1-3H3