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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=NN2C=NN=C2SCC3=CC=CC=C3

Isomeric SMILES

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

InChI

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