dimethyl 5-[2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylacetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanylacetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C3CCCCC3)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C3CCCCC3)C

InChI

InChI=1S/C23H29N3O5S/c1-14-15(2)26(19-8-6-5-7-9-19)23(24-14)32-13-20(27)25-18-11-16(21(28)30-3)10-17(12-18)22(29)31-4/h10-12,19H,5-9,13H2,1-4H3,(H,25,27)