2-(2-dimethylaminoethylsulfanyl)-4-oxidanyl-5-pentyl-1H-pyrimidin-6-one hydrochloride

Systemtic Name: 2-(2-dimethylaminoethylsulfanyl)-4-oxidanyl-5-pentyl-1H-pyrimidin-6-one hydrochloride Openeye Name: 2-(2-dimethylaminoethylsulfanyl)-4-hydroxy-5-pentyl-1H-pyrimidin-6-one hydrochloride CAS Name: 2-(2-dimethylaminoethylthio)-4-hydroxy-5-pentyl-1H-pyrimidin-6-one hydrochloride IUPAC Name: 2-(2-dimethylaminoethylsulfanyl)-4-hydroxy-5-pentyl-1H-pyrimidin-6-one hydrochloride Traditional Name: 5-amyl-2-(2-dimethylaminoethylthio)-4-hydroxy-1H-pyrimidin-6-one hydrochloride Formula: C13H24ClN3O2S MolecularWeight: 321.86656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(N=C(NC1=O)SCCN(C)C)O.Cl

Isomeric SMILES

CCCCCC1=C(N=C(NC1=O)SCCN(C)C)O.Cl

InChI

InChI=1S/C13H23N3O2S.ClH/c1-4-5-6-7-10-11(17)14-13(15-12(10)18)19-9-8-16(2)3;/h4-9H2,1-3H3,(H2,14,15,17,18);1H