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

Systemtic Name: tert-butyl [[4-chloranyl-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-ethyl-amino]sulfanylmethanoate Openeye Name: tert-butyl [[4-chloro-6-(isopropylamino)-1,3,5-triazin-2-yl]-ethyl-amino]sulfanylformate CAS Name: [[[4-chloro-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-ethylamino]thio]formic acid tert-butyl ester IUPAC Name: tert-butyl [[4-chloro-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-ethylamino]sulfanylformate Traditional Name: [[[4-chloro-6-(isopropylamino)-s-triazin-2-yl]-ethyl-amino]thio]formic acid tert-butyl ester Formula: C13H22ClN5O2S MolecularWeight: 347.86408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22ClN5O2S/c1-7-19(22-12(20)21-13(4,5)6)11-17-9(14)16-10(18-11)15-8(2)3/h8H,7H2,1-6H3,(H,15,16,17,18)