ethyl [[4-chloranyl-6-(2-cyanopropan-2-ylamino)-1,3,5-triazin-2-yl]-ethyl-amino]sulfanylmethanoate

Systemtic Name: ethyl [[4-chloranyl-6-(2-cyanopropan-2-ylamino)-1,3,5-triazin-2-yl]-ethyl-amino]sulfanylmethanoate Openeye Name: ethyl [[4-chloro-6-[(1-cyano-1-methyl-ethyl)amino]-1,3,5-triazin-2-yl]-ethyl-amino]sulfanylformate CAS Name: [[[4-chloro-6-(2-cyanopropan-2-ylamino)-1,3,5-triazin-2-yl]-ethylamino]thio]formic acid ethyl ester IUPAC Name: ethyl [[4-chloro-6-(2-cyanopropan-2-ylamino)-1,3,5-triazin-2-yl]-ethylamino]sulfanylformate Traditional Name: [[[4-chloro-6-[(1-cyano-1-methyl-ethyl)amino]-s-triazin-2-yl]-ethyl-amino]thio]formic acid ethyl ester Formula: C12H17ClN6O2S MolecularWeight: 344.82038

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC(=NC(=N1)NC(C)(C)C#N)Cl)SC(=O)OCC

Isomeric SMILES

CCN(C1=NC(=NC(=N1)NC(C)(C)C#N)Cl)SC(=O)OCC

InChI

InChI=1S/C12H17ClN6O2S/c1-5-19(22-11(20)21-6-2)10-16-8(13)15-9(17-10)18-12(3,4)7-14/h5-6H2,1-4H3,(H,15,16,17,18)