2-[[6-[(2-chlorophenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl]-N-(2-methylcyclohexyl)ethanamide

Systemtic Name: 2-[[6-[(2-chlorophenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl]-N-(2-methylcyclohexyl)ethanamide Openeye Name: 2-[[6-[(2-chlorophenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl]-N-(2-methylcyclohexyl)acetamide CAS Name: 2-[[6-[(2-chlorophenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]thio]-N-(2-methylcyclohexyl)acetamide IUPAC Name: 2-[[6-[(2-chlorophenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl]-N-(2-methylcyclohexyl)acetamide Traditional Name: 2-[[6-(2-chlorobenzyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]thio]-N-(2-methylcyclohexyl)acetamide Formula: C23H28ClN5OS MolecularWeight: 458.01932

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CSC2=NN3C(=C(C(=NC3=N2)C)CC4=CC=CC=C4Cl)C

Isomeric SMILES

CC1CCCCC1NC(=O)CSC2=NN3C(=C(C(=NC3=N2)C)CC4=CC=CC=C4Cl)C

InChI

InChI=1S/C23H28ClN5OS/c1-14-8-4-7-11-20(14)26-21(30)13-31-23-27-22-25-15(2)18(16(3)29(22)28-23)12-17-9-5-6-10-19(17)24/h5-6,9-10,14,20H,4,7-8,11-13H2,1-3H3,(H,26,30)