[5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 2-methylbenzoate

Systemtic Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 2-methylbenzoate Openeye Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 2-methylbenzoate CAS Name: 2-methylbenzoic acid [5-(dimethylsulfamoyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: [5-(dimethylsulfamoyl)-1-propylbenzimidazol-2-yl]methyl 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl ester Formula: C21H25N3O4S MolecularWeight: 415.5059

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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)C3=CC=CC=C3C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C21H25N3O4S/c1-5-12-24-19-11-10-16(29(26,27)23(3)4)13-18(19)22-20(24)14-28-21(25)17-9-7-6-8-15(17)2/h6-11,13H,5,12,14H2,1-4H3