ethyl 2-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methylsulfanyl]ethanoate

Systemtic Name: ethyl 2-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methylsulfanyl]ethanoate Openeye Name: ethyl 2-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methylsulfanyl]acetate CAS Name: 2-[(1-butyl-5-sulfamoyl-2-benzimidazolyl)methylthio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(1-butyl-5-sulfamoylbenzimidazol-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methylthio]acetic acid ethyl ester Formula: C16H23N3O4S2 MolecularWeight: 385.50152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSCC(=O)OCC

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSCC(=O)OCC

InChI

InChI=1S/C16H23N3O4S2/c1-3-5-8-19-14-7-6-12(25(17,21)22)9-13(14)18-15(19)10-24-11-16(20)23-4-2/h6-7,9H,3-5,8,10-11H2,1-2H3,(H2,17,21,22)