5,6-dimethyl-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1H-pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-1H-pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-1H-pyrimidin-4-one Traditional Name: 2-[(2-keto-2-pyrrolidino-ethyl)thio]-5,6-dimethyl-1H-pyrimidin-4-one Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SCC(=O)N2CCCC2)C

Isomeric SMILES

CC1=C(NC(=NC1=O)SCC(=O)N2CCCC2)C

InChI

InChI=1S/C12H17N3O2S/c1-8-9(2)13-12(14-11(8)17)18-7-10(16)15-5-3-4-6-15/h3-7H2,1-2H3,(H,13,14,17)