butyl 2-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]sulfanylethanoate

Systemtic Name: butyl 2-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]sulfanylethanoate Openeye Name: butyl 2-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-butyl-5-(dimethylsulfamoyl)-2-benzimidazolyl]thio]acetic acid butyl ester IUPAC Name: butyl 2-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]thio]acetic acid butyl ester Formula: C19H29N3O4S2 MolecularWeight: 427.58126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SCC(=O)OCCCC

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SCC(=O)OCCCC

InChI

InChI=1S/C19H29N3O4S2/c1-5-7-11-22-17-10-9-15(28(24,25)21(3)4)13-16(17)20-19(22)27-14-18(23)26-12-8-6-2/h9-10,13H,5-8,11-12,14H2,1-4H3