S-[[1-(diethylcarbamoyl)-1,2,4-triazol-3-yl]] N,N-diethylcarbamothioate

Systemtic Name: S-[[1-(diethylcarbamoyl)-1,2,4-triazol-3-yl]] N,N-diethylcarbamothioate Openeye Name: S-[[1-(diethylcarbamoyl)-1,2,4-triazol-3-yl]] N,N-diethylcarbamothioate CAS Name: N,N-diethylcarbamothioic acid S-[[1-[diethylamino(oxo)methyl]-1,2,4-triazol-3-yl]] ester IUPAC Name: S-[[1-(diethylcarbamoyl)-1,2,4-triazol-3-yl]] N,N-diethylcarbamothioate Traditional Name: N,N-diethylthiocarbamic acid S-[[1-(diethylcarbamoyl)-1,2,4-triazol-3-yl]] ester Formula: C12H21N5O2S MolecularWeight: 299.39244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1C=NC(=N1)SC(=O)N(CC)CC

Isomeric SMILES

CCN(CC)C(=O)N1C=NC(=N1)SC(=O)N(CC)CC

InChI

InChI=1S/C12H21N5O2S/c1-5-15(6-2)11(18)17-9-13-10(14-17)20-12(19)16(7-3)8-4/h9H,5-8H2,1-4H3