2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-1-piperidino-ethanone Formula: C12H18N4OS MolecularWeight: 266.36252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2CCCCC2)N

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2CCCCC2)N

InChI

InChI=1S/C12H18N4OS/c1-9-7-10(13)15-12(14-9)18-8-11(17)16-5-3-2-4-6-16/h7H,2-6,8H2,1H3,(H2,13,14,15)