6-tert-butyl-3-methyl-2-prop-2-enylsulfanyl-pyrimidin-4-one

Systemtic Name: 6-tert-butyl-3-methyl-2-prop-2-enylsulfanyl-pyrimidin-4-one Openeye Name: 2-allylsulfanyl-6-tert-butyl-3-methyl-pyrimidin-4-one CAS Name: 6-tert-butyl-3-methyl-2-(prop-2-enylthio)-4-pyrimidinone IUPAC Name: 6-tert-butyl-3-methyl-2-prop-2-enylsulfanylpyrimidin-4-one Traditional Name: 2-(allylthio)-6-tert-butyl-3-methyl-pyrimidin-4-one Formula: C12H18N2OS MolecularWeight: 238.34912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=O)N(C(=N1)SCC=C)C

Isomeric SMILES

CC(C)(C)C1=CC(=O)N(C(=N1)SCC=C)C

InChI

InChI=1S/C12H18N2OS/c1-6-7-16-11-13-9(12(2,3)4)8-10(15)14(11)5/h6,8H,1,7H2,2-5H3