[5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-(2-chlorophenyl)sulfanylpropanoate

Systemtic Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-(2-chlorophenyl)sulfanylpropanoate Openeye Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-(2-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(2-chlorophenyl)thio]propanoic acid [5-(dimethylsulfamoyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: [5-(dimethylsulfamoyl)-1-propylbenzimidazol-2-yl]methyl 3-(2-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(2-chlorophenyl)thio]propionic acid [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl ester Formula: C22H26ClN3O4S2 MolecularWeight: 496.04254

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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)CCSC3=CC=CC=C3Cl

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CCSC3=CC=CC=C3Cl

InChI

InChI=1S/C22H26ClN3O4S2/c1-4-12-26-19-10-9-16(32(28,29)25(2)3)14-18(19)24-21(26)15-30-22(27)11-13-31-20-8-6-5-7-17(20)23/h5-10,14H,4,11-13,15H2,1-3H3