N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]-2-(2,6-dimethylphenoxy)-N-ethyl-ethanamide

Systemtic Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]-2-(2,6-dimethylphenoxy)-N-ethyl-ethanamide Openeye Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]-2-(2,6-dimethylphenoxy)-N-ethyl-acetamide CAS Name: N-[5-(1-benzotriazolylmethyl)-1,3,4-thiadiazol-2-yl]-2-(2,6-dimethylphenoxy)-N-ethylacetamide IUPAC Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]-2-(2,6-dimethylphenoxy)-N-ethylacetamide Traditional Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]-2-(2,6-dimethylphenoxy)-N-ethyl-acetamide Formula: C21H22N6O2S MolecularWeight: 422.50338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NN=C(S1)CN2C3=CC=CC=C3N=N2)C(=O)COC4=C(C=CC=C4C)C

Isomeric SMILES

CCN(C1=NN=C(S1)CN2C3=CC=CC=C3N=N2)C(=O)COC4=C(C=CC=C4C)C

InChI

InChI=1S/C21H22N6O2S/c1-4-26(19(28)13-29-20-14(2)8-7-9-15(20)3)21-24-23-18(30-21)12-27-17-11-6-5-10-16(17)22-25-27/h5-11H,4,12-13H2,1-3H3