(5-methyl-2-propan-2-yl-cyclohexyl) 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetate CAS Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetate Traditional Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C20H28N2O2S MolecularWeight: 360.51352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)CSC2=NC3=C(N2)C=C(C=C3)C)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)CSC2=NC3=C(N2)C=C(C=C3)C)C(C)C

InChI

InChI=1S/C20H28N2O2S/c1-12(2)15-7-5-14(4)10-18(15)24-19(23)11-25-20-21-16-8-6-13(3)9-17(16)22-20/h6,8-9,12,14-15,18H,5,7,10-11H2,1-4H3,(H,21,22)