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

Systemtic Name: 2-(2-dimethylaminoethylsulfanyl)-5-(2-methylpropyl)-4-oxidanyl-1H-pyrimidin-6-one hydrochloride Openeye Name: 2-(2-dimethylaminoethylsulfanyl)-4-hydroxy-5-isobutyl-1H-pyrimidin-6-one hydrochloride CAS Name: 2-(2-dimethylaminoethylthio)-4-hydroxy-5-(2-methylpropyl)-1H-pyrimidin-6-one hydrochloride IUPAC Name: 2-(2-dimethylaminoethylsulfanyl)-4-hydroxy-5-(2-methylpropyl)-1H-pyrimidin-6-one hydrochloride Traditional Name: 2-(2-dimethylaminoethylthio)-4-hydroxy-5-isobutyl-1H-pyrimidin-6-one hydrochloride Formula: C12H22ClN3O2S MolecularWeight: 307.83998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(N=C(NC1=O)SCCN(C)C)O.Cl

Isomeric SMILES

CC(C)CC1=C(N=C(NC1=O)SCCN(C)C)O.Cl

InChI

InChI=1S/C12H21N3O2S.ClH/c1-8(2)7-9-10(16)13-12(14-11(9)17)18-6-5-15(3)4;/h8H,5-7H2,1-4H3,(H2,13,14,16,17);1H