methyl 2-(4-acetyloxyphenyl)-3-cyclohexyl-thieno[2,3-d]imidazole-5-carboxylate

Systemtic Name: methyl 2-(4-acetyloxyphenyl)-3-cyclohexyl-thieno[2,3-d]imidazole-5-carboxylate Openeye Name: methyl 2-(4-acetoxyphenyl)-3-cyclohexyl-thieno[2,3-d]imidazole-5-carboxylate CAS Name: 2-(4-acetyloxyphenyl)-3-cyclohexyl-5-thieno[2,3-d]imidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-acetyloxyphenyl)-3-cyclohexylthieno[2,3-d]imidazole-5-carboxylate Traditional Name: 2-(4-acetoxyphenyl)-3-cyclohexyl-thien[2,3-d]imidazole-5-carboxylic acid methyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2=NC3=C(N2C4CCCCC4)SC(=C3)C(=O)OC

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2=NC3=C(N2C4CCCCC4)SC(=C3)C(=O)OC

InChI

InChI=1S/C21H22N2O4S/c1-13(24)27-16-10-8-14(9-11-16)19-22-17-12-18(21(25)26-2)28-20(17)23(19)15-6-4-3-5-7-15/h8-12,15H,3-7H2,1-2H3