ethyl 5-methyl-1-[(4-methylphenyl)sulfonylamino]-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[(4-methylphenyl)sulfonylamino]-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-(p-tolylsulfonylamino)triazole-4-carboxylate CAS Name: 5-methyl-1-[(4-methylphenyl)sulfonylamino]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[(4-methylphenyl)sulfonylamino]triazole-4-carboxylate Traditional Name: 5-methyl-1-(tosylamino)triazole-4-carboxylic acid ethyl ester Formula: C13H16N4O4S MolecularWeight: 324.35554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)NS(=O)(=O)C2=CC=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)NS(=O)(=O)C2=CC=C(C=C2)C)C

InChI

InChI=1S/C13H16N4O4S/c1-4-21-13(18)12-10(3)17(15-14-12)16-22(19,20)11-7-5-9(2)6-8-11/h5-8,16H,4H2,1-3H3