3-[[1-(4-methoxy-6-methyl-pyrimidin-2-yl)-1,2-diazirin-3-yl]sulfanyl]pentane-2,4-dione

Systemtic Name: 3-[[1-(4-methoxy-6-methyl-pyrimidin-2-yl)-1,2-diazirin-3-yl]sulfanyl]pentane-2,4-dione Openeye Name: 3-[1-(4-methoxy-6-methyl-pyrimidin-2-yl)diazirin-3-yl]sulfanylpentane-2,4-dione CAS Name: 3-[[1-(4-methoxy-6-methyl-2-pyrimidinyl)-3-diazirinyl]thio]pentane-2,4-dione IUPAC Name: 3-[1-(4-methoxy-6-methylpyrimidin-2-yl)diazirin-3-yl]sulfanylpentane-2,4-dione Traditional Name: 3-[[1-(4-methoxy-6-methyl-pyrimidin-2-yl)diazirin-3-yl]thio]pentane-2,4-dione Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=N2)SC(C(=O)C)C(=O)C)OC

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=N2)SC(C(=O)C)C(=O)C)OC

InChI

InChI=1S/C12H14N4O3S/c1-6-5-9(19-4)14-11(13-6)16-12(15-16)20-10(7(2)17)8(3)18/h5,10H,1-4H3