6-[1-(4-dimethylaminophenyl)-1-oxidanyl-ethyl]-5-methyl-2-methylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-[1-(4-dimethylaminophenyl)-1-oxidanyl-ethyl]-5-methyl-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-[1-(4-dimethylaminophenyl)-1-hydroxy-ethyl]-5-methyl-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-[1-(4-dimethylaminophenyl)-1-hydroxyethyl]-5-methyl-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 6-[1-(4-dimethylaminophenyl)-1-hydroxyethyl]-5-methyl-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-[1-(4-dimethylaminophenyl)-1-hydroxy-ethyl]-5-methyl-2-(methylthio)-1H-pyrimidin-4-one Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SC)C(C)(C2=CC=C(C=C2)N(C)C)O

Isomeric SMILES

CC1=C(NC(=NC1=O)SC)C(C)(C2=CC=C(C=C2)N(C)C)O

InChI

InChI=1S/C16H21N3O2S/c1-10-13(17-15(22-5)18-14(10)20)16(2,21)11-6-8-12(9-7-11)19(3)4/h6-9,21H,1-5H3,(H,17,18,20)