1-[3-[5-methyl-2-(pyridin-2-ylmethylsulfanyl)pyrimidin-4-yl]piperidin-1-yl]-2-morpholin-4-yl-propan-1-one

Systemtic Name: 1-[3-[5-methyl-2-(pyridin-2-ylmethylsulfanyl)pyrimidin-4-yl]piperidin-1-yl]-2-morpholin-4-yl-propan-1-one Openeye Name: 1-[3-[5-methyl-2-(2-pyridylmethylsulfanyl)pyrimidin-4-yl]-1-piperidyl]-2-morpholino-propan-1-one CAS Name: 1-[3-[5-methyl-2-(2-pyridinylmethylthio)-4-pyrimidinyl]-1-piperidinyl]-2-(4-morpholinyl)-1-propanone IUPAC Name: 1-[3-[5-methyl-2-(pyridin-2-ylmethylsulfanyl)pyrimidin-4-yl]piperidin-1-yl]-2-morpholin-4-ylpropan-1-one Traditional Name: 1-[3-[5-methyl-2-(2-pyridylmethylthio)pyrimidin-4-yl]piperidino]-2-morpholino-propan-1-one Formula: C23H31N5O2S MolecularWeight: 441.58954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2CCCN(C2)C(=O)C(C)N3CCOCC3)SCC4=CC=CC=N4

Isomeric SMILES

CC1=CN=C(N=C1C2CCCN(C2)C(=O)C(C)N3CCOCC3)SCC4=CC=CC=N4

InChI

InChI=1S/C23H31N5O2S/c1-17-14-25-23(31-16-20-7-3-4-8-24-20)26-21(17)19-6-5-9-28(15-19)22(29)18(2)27-10-12-30-13-11-27/h3-4,7-8,14,18-19H,5-6,9-13,15-16H2,1-2H3