N-tert-butyl-5-(1,1,1,3,3,3-hexadeuteriopropan-2-yl)-3-oxidanylidene-1H-1,2,4-triazole-2-carboxamide

Systemtic Name: N-tert-butyl-5-(1,1,1,3,3,3-hexadeuteriopropan-2-yl)-3-oxidanylidene-1H-1,2,4-triazole-2-carboxamide Openeye Name: N-tert-butyl-3-oxo-5-[2,2,2-trideuterio-1-(trideuteriomethyl)ethyl]-1H-1,2,4-triazole-2-carboxamide CAS Name: N-tert-butyl-5-(1,1,1,3,3,3-hexadeuteriopropan-2-yl)-3-oxo-1H-1,2,4-triazole-2-carboxamide IUPAC Name: N-tert-butyl-5-(1,1,1,3,3,3-hexadeuteriopropan-2-yl)-3-oxo-1H-1,2,4-triazole-2-carboxamide Traditional Name: N-tert-butyl-3-keto-5-[2,2,2-trideuterio-1-(trideuteriomethyl)ethyl]-1H-1,2,4-triazole-2-carboxamide Formula: C10H18N4O2 MolecularWeight: 232.312491

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=O)N(N1)C(=O)NC(C)(C)C

Isomeric SMILES

[2H]C([2H])([2H])C(C1=NC(=O)N(N1)C(=O)NC(C)(C)C)C([2H])([2H])[2H]

InChI

InChI=1S/C10H18N4O2/c1-6(2)7-11-8(15)14(13-7)9(16)12-10(3,4)5/h6H,1-5H3,(H,12,16)(H,11,13,15)/i1D3,2D3