1-(2-ethoxyphenyl)-N-[3-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]methanimine

Systemtic Name: 1-(2-ethoxyphenyl)-N-[3-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]methanimine Openeye Name: N-(3-benzylsulfanyl-1,2,4-triazol-4-yl)-1-(2-ethoxyphenyl)methanimine CAS Name: 1-(2-ethoxyphenyl)-N-[3-(phenylmethylthio)-1,2,4-triazol-4-yl]methanimine IUPAC Name: N-(3-benzylsulfanyl-1,2,4-triazol-4-yl)-1-(2-ethoxyphenyl)methanimine Traditional Name: (E)-[3-(benzylthio)-1,2,4-triazol-4-yl]-(2-ethoxybenzylidene)amine Formula: C18H18N4OS MolecularWeight: 338.42672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C=NN2C=NN=C2SCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=CC=C1/C=N/N2C=NN=C2SCC3=CC=CC=C3

InChI

InChI=1S/C18H18N4OS/c1-2-23-17-11-7-6-10-16(17)12-20-22-14-19-21-18(22)24-13-15-8-4-3-5-9-15/h3-12,14H,2,13H2,1H3/b20-12+