2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[(3,3-dimethyl-2-oxobutyl)thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[(2-keto-3,3-dimethyl-butyl)thio]-6-propyl-1H-pyrimidin-4-one Formula: C13H20N2O2S MolecularWeight: 268.3751

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)C(C)(C)C

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)C(C)(C)C

InChI

InChI=1S/C13H20N2O2S/c1-5-6-9-7-11(17)15-12(14-9)18-8-10(16)13(2,3)4/h7H,5-6,8H2,1-4H3,(H,14,15,17)