zinc 1-(2-azanyl-6-methyl-pyrimidin-4-yl)-1,2-diazirine-3-thiolate

Systemtic Name: zinc 1-(2-azanyl-6-methyl-pyrimidin-4-yl)-1,2-diazirine-3-thiolate Openeye Name: zinc 1-(2-amino-6-methyl-pyrimidin-4-yl)diazirine-3-thiolate CAS Name: zinc 1-(2-amino-6-methyl-4-pyrimidinyl)-3-diazirinethiolate IUPAC Name: zinc 1-(2-amino-6-methylpyrimidin-4-yl)diazirine-3-thiolate Traditional Name: zinc 1-(2-amino-6-methyl-pyrimidin-4-yl)diazirine-3-thiolate Formula: C12H12N10S2Zn MolecularWeight: 425.82968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N)N2C(=N2)[S-].CC1=CC(=NC(=N1)N)N2C(=N2)[S-].[Zn+2]

Isomeric SMILES

CC1=CC(=NC(=N1)N)N2C(=N2)[S-].CC1=CC(=NC(=N1)N)N2C(=N2)[S-].[Zn+2]

InChI

InChI=1S/2C6H7N5S.Zn/c2*1-3-2-4(9-5(7)8-3)11-6(12)10-11;/h2*2H,1H3,(H,10,12)(H2,7,8,9);/q;;+2/p-2