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

Systemtic Name: cyclohexyl 2-[1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)benzimidazol-2-yl]sulfanylethanoate Openeye Name: cyclohexyl 2-[1-(2-morpholino-2-oxo-ethyl)benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-[2-(4-morpholinyl)-2-oxoethyl]-2-benzimidazolyl]thio]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[1-(2-morpholin-4-yl-2-oxoethyl)benzimidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(2-keto-2-morpholino-ethyl)benzimidazol-2-yl]thio]acetic acid cyclohexyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)CSC2=NC3=CC=CC=C3N2CC(=O)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)OC(=O)CSC2=NC3=CC=CC=C3N2CC(=O)N4CCOCC4

InChI

InChI=1S/C21H27N3O4S/c25-19(23-10-12-27-13-11-23)14-24-18-9-5-4-8-17(18)22-21(24)29-15-20(26)28-16-6-2-1-3-7-16/h4-5,8-9,16H,1-3,6-7,10-15H2