2-(2,3-dimethylphenoxy)-N-[3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]ethanamide

Systemtic Name: 2-(2,3-dimethylphenoxy)-N-[3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]ethanamide Openeye Name: N-(3-benzylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-2-(2,3-dimethylphenoxy)acetamide CAS Name: 2-(2,3-dimethylphenoxy)-N-[3-methyl-5-(phenylmethylthio)-1,2,4-triazol-4-yl]acetamide IUPAC Name: N-(3-benzylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-2-(2,3-dimethylphenoxy)acetamide Traditional Name: N-[3-(benzylthio)-5-methyl-1,2,4-triazol-4-yl]-2-(2,3-dimethylphenoxy)acetamide Formula: C20H22N4O2S MolecularWeight: 382.47928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCC(=O)NN2C(=NN=C2SCC3=CC=CC=C3)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)OCC(=O)NN2C(=NN=C2SCC3=CC=CC=C3)C)C

InChI

InChI=1S/C20H22N4O2S/c1-14-8-7-11-18(15(14)2)26-12-19(25)23-24-16(3)21-22-20(24)27-13-17-9-5-4-6-10-17/h4-11H,12-13H2,1-3H3,(H,23,25)