2-(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-ethanamide

Systemtic Name: 2-(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-ethanamide Openeye Name: 2-[4-chloro-6-(1-piperidyl)pyrimidin-2-yl]sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-acetamide CAS Name: 2-[[4-chloro-6-(1-piperidinyl)-2-pyrimidinyl]thio]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylacetamide IUPAC Name: 2-(4-chloro-6-piperidin-1-ylpyrimidin-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylacetamide Traditional Name: 2-[(4-chloro-6-piperidino-pyrimidin-2-yl)thio]-N-homoveratryl-N-methyl-acetamide Formula: C22H29ClN4O3S MolecularWeight: 465.00866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)CSC2=NC(=CC(=N2)Cl)N3CCCCC3

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)CSC2=NC(=CC(=N2)Cl)N3CCCCC3

InChI

InChI=1S/C22H29ClN4O3S/c1-26(12-9-16-7-8-17(29-2)18(13-16)30-3)21(28)15-31-22-24-19(23)14-20(25-22)27-10-5-4-6-11-27/h7-8,13-14H,4-6,9-12,15H2,1-3H3