(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 4-(5-chloro-2-thienyl)-4-oxo-butanoate CAS Name: 4-(5-chloro-2-thiophenyl)-4-oxobutanoic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 4-(5-chlorothiophen-2-yl)-4-oxobutanoate Traditional Name: 4-(5-chloro-2-thienyl)-4-keto-butyric acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C20H22ClN3O5S2 MolecularWeight: 483.98878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)CCC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)CCC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C20H22ClN3O5S2/c1-2-3-10-24-15-5-4-13(31(22,27)28)11-14(15)23-19(24)12-29-20(26)9-6-16(25)17-7-8-18(21)30-17/h4-5,7-8,11H,2-3,6,9-10,12H2,1H3,(H2,22,27,28)