methyl 4-[3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]propanoylamino]butanoate

Systemtic Name: methyl 4-[3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]propanoylamino]butanoate Openeye Name: methyl 4-[3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]propanoylamino]butanoate CAS Name: 4-[[3-[1-butyl-5-(dimethylsulfamoyl)-2-benzimidazolyl]-1-oxopropyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]propanoylamino]butanoate Traditional Name: 4-[3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]propanoylamino]butyric acid methyl ester Formula: C21H32N4O5S MolecularWeight: 452.56758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NCCCC(=O)OC

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NCCCC(=O)OC

InChI

InChI=1S/C21H32N4O5S/c1-5-6-14-25-18-10-9-16(31(28,29)24(2)3)15-17(18)23-19(25)11-12-20(26)22-13-7-8-21(27)30-4/h9-10,15H,5-8,11-14H2,1-4H3,(H,22,26)