[3-[5-methyl-2-(oxolan-2-ylmethylsulfanyl)pyrimidin-4-yl]piperidin-1-yl]-(2-methylpyrazol-3-yl)methanone

Systemtic Name: [3-[5-methyl-2-(oxolan-2-ylmethylsulfanyl)pyrimidin-4-yl]piperidin-1-yl]-(2-methylpyrazol-3-yl)methanone Openeye Name: (2-methylpyrazol-3-yl)-[3-[5-methyl-2-(tetrahydrofuran-2-ylmethylsulfanyl)pyrimidin-4-yl]-1-piperidyl]methanone CAS Name: [3-[5-methyl-2-(2-oxolanylmethylthio)-4-pyrimidinyl]-1-piperidinyl]-(2-methyl-3-pyrazolyl)methanone IUPAC Name: [3-[5-methyl-2-(oxolan-2-ylmethylsulfanyl)pyrimidin-4-yl]piperidin-1-yl]-(2-methylpyrazol-3-yl)methanone Traditional Name: (2-methylpyrazol-3-yl)-[3-[5-methyl-2-(tetrahydrofurfurylthio)pyrimidin-4-yl]piperidino]methanone Formula: C20H27N5O2S MolecularWeight: 401.52568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2CCCN(C2)C(=O)C3=CC=NN3C)SCC4CCCO4

Isomeric SMILES

CC1=CN=C(N=C1C2CCCN(C2)C(=O)C3=CC=NN3C)SCC4CCCO4

InChI

InChI=1S/C20H27N5O2S/c1-14-11-21-20(28-13-16-6-4-10-27-16)23-18(14)15-5-3-9-25(12-15)19(26)17-7-8-22-24(17)2/h7-8,11,15-16H,3-6,9-10,12-13H2,1-2H3