3-(3,4-dimethoxyphenyl)-5-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(3,4-dimethoxyphenyl)-5-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(3,4-dimethoxyphenyl)-5-[2-(4-ethoxyphenoxy)ethylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(3,4-dimethoxyphenyl)-5-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(3,4-dimethoxyphenyl)-5-[2-(4-ethoxyphenoxy)ethylthio]-1,2,4-triazol-4-yl]amine Formula: C20H24N4O4S MolecularWeight: 416.49396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSC2=NN=C(N2N)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSC2=NN=C(N2N)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H24N4O4S/c1-4-27-15-6-8-16(9-7-15)28-11-12-29-20-23-22-19(24(20)21)14-5-10-17(25-2)18(13-14)26-3/h5-10,13H,4,11-12,21H2,1-3H3