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

Systemtic Name: 2-(2-dimethylaminoethylsulfanyl)-5-hexyl-4-oxidanyl-1H-pyrimidin-6-one hydrochloride Openeye Name: 2-(2-dimethylaminoethylsulfanyl)-5-hexyl-4-hydroxy-1H-pyrimidin-6-one hydrochloride CAS Name: 2-(2-dimethylaminoethylthio)-5-hexyl-4-hydroxy-1H-pyrimidin-6-one hydrochloride IUPAC Name: 2-(2-dimethylaminoethylsulfanyl)-5-hexyl-4-hydroxy-1H-pyrimidin-6-one hydrochloride Traditional Name: 2-(2-dimethylaminoethylthio)-5-hexyl-4-hydroxy-1H-pyrimidin-6-one hydrochloride Formula: C14H26ClN3O2S MolecularWeight: 335.89314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(N=C(NC1=O)SCCN(C)C)O.Cl

Isomeric SMILES

CCCCCCC1=C(N=C(NC1=O)SCCN(C)C)O.Cl

InChI

InChI=1S/C14H25N3O2S.ClH/c1-4-5-6-7-8-11-12(18)15-14(16-13(11)19)20-10-9-17(2)3;/h4-10H2,1-3H3,(H2,15,16,18,19);1H