dimethyl 2-[2-[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylethanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-[[5-chloro-1-(2-methoxyethyl)-2-benzimidazolyl]thio]-1-oxoethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-[[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]thio]acetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C22H22ClN3O6S MolecularWeight: 491.94458

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=C(C=CC(=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

COCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=C(C=CC(=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C22H22ClN3O6S/c1-30-9-8-26-18-7-5-14(23)11-17(18)25-22(26)33-12-19(27)24-16-10-13(20(28)31-2)4-6-15(16)21(29)32-3/h4-7,10-11H,8-9,12H2,1-3H3,(H,24,27)