5-hexyl-4-oxidanyl-2-(2-piperidin-1-ylethylsulfanyl)-1H-pyrimidin-6-one

Systemtic Name: 5-hexyl-4-oxidanyl-2-(2-piperidin-1-ylethylsulfanyl)-1H-pyrimidin-6-one Openeye Name: 5-hexyl-4-hydroxy-2-[2-(1-piperidyl)ethylsulfanyl]-1H-pyrimidin-6-one CAS Name: 5-hexyl-4-hydroxy-2-[2-(1-piperidinyl)ethylthio]-1H-pyrimidin-6-one IUPAC Name: 5-hexyl-4-hydroxy-2-(2-piperidin-1-ylethylsulfanyl)-1H-pyrimidin-6-one Traditional Name: 5-hexyl-4-hydroxy-2-(2-piperidinoethylthio)-1H-pyrimidin-6-one Formula: C17H29N3O2S MolecularWeight: 339.49606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(N=C(NC1=O)SCCN2CCCCC2)O

Isomeric SMILES

CCCCCCC1=C(N=C(NC1=O)SCCN2CCCCC2)O

InChI

InChI=1S/C17H29N3O2S/c1-2-3-4-6-9-14-15(21)18-17(19-16(14)22)23-13-12-20-10-7-5-8-11-20/h2-13H2,1H3,(H2,18,19,21,22)