[5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-(1,3,5-trimethylpyrazol-4-yl)propanoate

Systemtic Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-(1,3,5-trimethylpyrazol-4-yl)propanoate Openeye Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-(1,3,5-trimethylpyrazol-4-yl)propanoate CAS Name: 3-(1,3,5-trimethyl-4-pyrazolyl)propanoic acid [5-(dimethylsulfamoyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: [5-(dimethylsulfamoyl)-1-propylbenzimidazol-2-yl]methyl 3-(1,3,5-trimethylpyrazol-4-yl)propanoate Traditional Name: 3-(1,3,5-trimethylpyrazol-4-yl)propionic acid [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl ester Formula: C22H31N5O4S MolecularWeight: 461.57764

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CCC3=C(N(N=C3C)C)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CCC3=C(N(N=C3C)C)C

InChI

InChI=1S/C22H31N5O4S/c1-7-12-27-20-10-8-17(32(29,30)25(4)5)13-19(20)23-21(27)14-31-22(28)11-9-18-15(2)24-26(6)16(18)3/h8,10,13H,7,9,11-12,14H2,1-6H3