2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-(3,5-dimethylpiperidin-1-yl)ethanone

Systemtic Name: 2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-(3,5-dimethylpiperidin-1-yl)ethanone Openeye Name: 2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-1-(3,5-dimethyl-1-piperidyl)ethanone CAS Name: 2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-1-(3,5-dimethyl-1-piperidinyl)ethanone IUPAC Name: 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-1-(3,5-dimethylpiperidin-1-yl)ethanone Traditional Name: 2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-1-(3,5-dimethylpiperidino)ethanone Formula: C14H22N4OS MolecularWeight: 294.41568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CSC2=NC(=CC(=N2)N)C)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CSC2=NC(=CC(=N2)N)C)C

InChI

InChI=1S/C14H22N4OS/c1-9-4-10(2)7-18(6-9)13(19)8-20-14-16-11(3)5-12(15)17-14/h5,9-10H,4,6-8H2,1-3H3,(H2,15,16,17)