2-[2-(dipropylamino)ethylsulfanyl]-5-heptyl-4-oxidanyl-1H-pyrimidin-6-one hydrochloride

Systemtic Name: 2-[2-(dipropylamino)ethylsulfanyl]-5-heptyl-4-oxidanyl-1H-pyrimidin-6-one hydrochloride Openeye Name: 2-[2-(dipropylamino)ethylsulfanyl]-5-heptyl-4-hydroxy-1H-pyrimidin-6-one hydrochloride CAS Name: 2-[2-(dipropylamino)ethylthio]-5-heptyl-4-hydroxy-1H-pyrimidin-6-one hydrochloride IUPAC Name: 2-[2-(dipropylamino)ethylsulfanyl]-5-heptyl-4-hydroxy-1H-pyrimidin-6-one hydrochloride Traditional Name: 2-[2-(dipropylamino)ethylthio]-5-heptyl-4-hydroxy-1H-pyrimidin-6-one hydrochloride Formula: C19H36ClN3O2S MolecularWeight: 406.02604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(N=C(NC1=O)SCCN(CCC)CCC)O.Cl

Isomeric SMILES

CCCCCCCC1=C(N=C(NC1=O)SCCN(CCC)CCC)O.Cl

InChI

InChI=1S/C19H35N3O2S.ClH/c1-4-7-8-9-10-11-16-17(23)20-19(21-18(16)24)25-15-14-22(12-5-2)13-6-3;/h4-15H2,1-3H3,(H2,20,21,23,24);1H