6-[(3R)-1-[(2-ethylsulfanylpyrimidin-5-yl)methyl]piperidin-3-yl]-1H-pyrimidin-4-one

Systemtic Name: 6-[(3R)-1-[(2-ethylsulfanylpyrimidin-5-yl)methyl]piperidin-3-yl]-1H-pyrimidin-4-one Openeye Name: 6-[(3R)-1-[(2-ethylsulfanylpyrimidin-5-yl)methyl]-3-piperidyl]-1H-pyrimidin-4-one CAS Name: 6-[(3R)-1-[[2-(ethylthio)-5-pyrimidinyl]methyl]-3-piperidinyl]-1H-pyrimidin-4-one IUPAC Name: 6-[(3R)-1-[(2-ethylsulfanylpyrimidin-5-yl)methyl]piperidin-3-yl]-1H-pyrimidin-4-one Traditional Name: 6-[(3R)-1-[[2-(ethylthio)pyrimidin-5-yl]methyl]-3-piperidyl]-1H-pyrimidin-4-one Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C=N1)CN2CCCC(C2)C3=CC(=O)N=CN3

Isomeric SMILES

CCSC1=NC=C(C=N1)CN2CCC[C@H](C2)C3=CC(=O)N=CN3

InChI

InChI=1S/C16H21N5OS/c1-2-23-16-17-7-12(8-18-16)9-21-5-3-4-13(10-21)14-6-15(22)20-11-19-14/h6-8,11,13H,2-5,9-10H2,1H3,(H,19,20,22)/t13-/m1/s1