cyclohexyl 2-[1-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]sulfanylethanoate

Systemtic Name: cyclohexyl 2-[1-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]sulfanylethanoate Openeye Name: cyclohexyl 2-[1-[2-(4-methoxyphenyl)-2-oxo-ethyl]benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-[2-(4-methoxyphenyl)-2-oxoethyl]-2-benzimidazolyl]thio]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[1-[2-(4-methoxyphenyl)-2-oxoethyl]benzimidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-[2-keto-2-(4-methoxyphenyl)ethyl]benzimidazol-2-yl]thio]acetic acid cyclohexyl ester Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CN2C3=CC=CC=C3N=C2SCC(=O)OC4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CN2C3=CC=CC=C3N=C2SCC(=O)OC4CCCCC4

InChI

InChI=1S/C24H26N2O4S/c1-29-18-13-11-17(12-14-18)22(27)15-26-21-10-6-5-9-20(21)25-24(26)31-16-23(28)30-19-7-3-2-4-8-19/h5-6,9-14,19H,2-4,7-8,15-16H2,1H3