2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-6-propyl-1H-pyrimidin-4-one Formula: C13H17N3O2S MolecularWeight: 279.35798

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=C(ON=C2C)C

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=C(ON=C2C)C

InChI

InChI=1S/C13H17N3O2S/c1-4-5-10-6-12(17)15-13(14-10)19-7-11-8(2)16-18-9(11)3/h6H,4-5,7H2,1-3H3,(H,14,15,17)