Carbamic acid, [(4,5-dihydro-4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]-, 1,1-dimethylethyl ester

CAS Registry Number®

306935-45-5
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CAS Name

Carbamic acid, [(4,5-dihydro-4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]-, 1,1-dimethylethyl ester

Molecular Formula

C14H18N4O2S

Molecular Mass

306.38

Cite this Page

Carbamic acid, [(4,5-dihydro-4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]-, 1,1-dimethylethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=306935-45-5 (retrieved 2024-04-20) (CAS RN: 306935-45-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H18N4O2S/c1-14(2,3)20-13(19)15-9-11-16-17-12(21)18(11)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H,15,19)(H,17,21)

InChIKey

InChIKey=MLKWKXJCGAYVOB-UHFFFAOYSA-N

SMILES

C(NC(OC(C)(C)C)=O)C=1N(C(=S)NN1)C2=CC=CC=C2

Canonical SMILES

O=C(OC(C)(C)C)NCC1=NNC(=S)N1C=2C=CC=CC2

Other Names for this Substance

  • Carbamic acid, [(4,5-dihydro-4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]-, 1,1-dimethylethyl ester
  • [(5-Mercapto-4-phenyl-4H-[1,2,4]triazol-3-yl)methyl]carbamic acid tert-butyl ester

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