(5R,6R)-2-azanyl-3,5,6-trimethyl-6-[1-(5-prop-1-ynylpyridin-3-yl)piperidin-3-yl]-5H-pyrimidin-4-one

Systemtic Name: (5R,6R)-2-azanyl-3,5,6-trimethyl-6-[1-(5-prop-1-ynylpyridin-3-yl)piperidin-3-yl]-5H-pyrimidin-4-one Openeye Name: (5R,6R)-2-amino-3,5,6-trimethyl-6-[1-(5-prop-1-ynyl-3-pyridyl)-3-piperidyl]-5H-pyrimidin-4-one CAS Name: (5R,6R)-2-amino-3,5,6-trimethyl-6-[1-(5-prop-1-ynyl-3-pyridinyl)-3-piperidinyl]-5H-pyrimidin-4-one IUPAC Name: (5R,6R)-2-amino-3,5,6-trimethyl-6-[1-(5-prop-1-ynylpyridin-3-yl)piperidin-3-yl]-5H-pyrimidin-4-one Traditional Name: (5R,6R)-2-amino-3,5,6-trimethyl-6-[1-(5-prop-1-ynyl-3-pyridyl)-3-piperidyl]-5H-pyrimidin-4-one Formula: C20H27N5O MolecularWeight: 353.46128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC(=CN=C1)N2CCCC(C2)C3(C(C(=O)N(C(=N3)N)C)C)C

Isomeric SMILES

CC#CC1=CC(=CN=C1)N2CCCC(C2)[C@@]3([C@H](C(=O)N(C(=N3)N)C)C)C

InChI

InChI=1S/C20H27N5O/c1-5-7-15-10-17(12-22-11-15)25-9-6-8-16(13-25)20(3)14(2)18(26)24(4)19(21)23-20/h10-12,14,16H,6,8-9,13H2,1-4H3,(H2,21,23)/t14-,16?,20-/m0/s1