methyl 2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylethanoate

Systemtic Name: methyl 2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylethanoate Openeye Name: methyl 2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylacetate CAS Name: 2-[(1-butyl-5-sulfamoyl-2-benzimidazolyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(1-butyl-5-sulfamoylbenzimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)thio]acetic acid methyl ester Formula: C14H19N3O4S2 MolecularWeight: 357.44836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O4S2/c1-3-4-7-17-12-6-5-10(23(15,19)20)8-11(12)16-14(17)22-9-13(18)21-2/h5-6,8H,3-4,7,9H2,1-2H3,(H2,15,19,20)