methyl 5-chloranyl-2-[[5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methylamino]benzoate

Systemtic Name: methyl 5-chloranyl-2-[[5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methylamino]benzoate Openeye Name: methyl 5-chloro-2-[[5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methylamino]benzoate CAS Name: 5-chloro-2-[[5-(dimethylsulfamoyl)-1-propyl-2-benzimidazolyl]methylamino]benzoic acid methyl ester IUPAC Name: methyl 5-chloro-2-[[5-(dimethylsulfamoyl)-1-propylbenzimidazol-2-yl]methylamino]benzoate Traditional Name: 5-chloro-2-[[5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methylamino]benzoic acid methyl ester Formula: C21H25ClN4O4S MolecularWeight: 464.9656

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CNC3=C(C=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CNC3=C(C=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C21H25ClN4O4S/c1-5-10-26-19-9-7-15(31(28,29)25(2)3)12-18(19)24-20(26)13-23-17-8-6-14(22)11-16(17)21(27)30-4/h6-9,11-12,23H,5,10,13H2,1-4H3