N-[4-(2,6-dimethylmorpholin-4-yl)carbothioyl-1,2,3-triazol-1-yl]-1-methyl-5-oxidanylidene-2H-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[4-(2,6-dimethylmorpholin-4-yl)carbothioyl-1,2,3-triazol-1-yl]-1-methyl-5-oxidanylidene-2H-1,2,3-triazole-4-carboxamide Openeye Name: N-[4-(2,6-dimethylmorpholine-4-carbothioyl)triazol-1-yl]-1-methyl-5-oxo-2H-triazole-4-carboxamide CAS Name: N-[4-[(2,6-dimethyl-4-morpholinyl)-sulfanylidenemethyl]-1-triazolyl]-1-methyl-5-oxo-2H-triazole-4-carboxamide IUPAC Name: N-[4-(2,6-dimethylmorpholine-4-carbothioyl)triazol-1-yl]-1-methyl-5-oxo-2H-triazole-4-carboxamide Traditional Name: N-[4-(2,6-dimethylmorpholine-4-carbothioyl)triazol-1-yl]-5-keto-1-methyl-2H-triazole-4-carboxamide Formula: C13H18N8O3S MolecularWeight: 366.39882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=S)C2=CN(N=N2)NC(=O)C3=NNN(C3=O)C

Isomeric SMILES

CC1CN(CC(O1)C)C(=S)C2=CN(N=N2)NC(=O)C3=NNN(C3=O)C

InChI

InChI=1S/C13H18N8O3S/c1-7-4-20(5-8(2)24-7)13(25)9-6-21(18-14-9)16-11(22)10-12(23)19(3)17-15-10/h6-8,17H,4-5H2,1-3H3,(H,16,22)