ethyl 2-[[1-(2-azanyl-6-methyl-pyrimidin-4-yl)-1,2-diazirin-3-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[1-(2-azanyl-6-methyl-pyrimidin-4-yl)-1,2-diazirin-3-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[1-(2-amino-6-methyl-pyrimidin-4-yl)diazirin-3-yl]sulfanylacetate CAS Name: 2-[[1-(2-amino-6-methyl-4-pyrimidinyl)-3-diazirinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-(2-amino-6-methylpyrimidin-4-yl)diazirin-3-yl]sulfanylacetate Traditional Name: 2-[[1-(2-amino-6-methyl-pyrimidin-4-yl)diazirin-3-yl]thio]acetic acid ethyl ester Formula: C10H13N5O2S MolecularWeight: 267.30752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN1C2=NC(=NC(=C2)C)N

Isomeric SMILES

CCOC(=O)CSC1=NN1C2=NC(=NC(=C2)C)N

InChI

InChI=1S/C10H13N5O2S/c1-3-17-8(16)5-18-10-14-15(10)7-4-6(2)12-9(11)13-7/h4H,3,5H2,1-2H3,(H2,11,12,13)