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

Systemtic Name: tert-butyl [[4-chloranyl-6-(2-cyanopropan-2-ylamino)-1,3,5-triazin-2-yl]-ethyl-amino]sulfanylmethanoate Openeye Name: tert-butyl [[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 tert-butyl ester IUPAC Name: tert-butyl [[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 tert-butyl ester Formula: C14H21ClN6O2S MolecularWeight: 372.87354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21ClN6O2S/c1-7-21(24-12(22)23-13(2,3)4)11-18-9(15)17-10(19-11)20-14(5,6)8-16/h7H2,1-6H3,(H,17,18,19,20)