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

Systemtic Name: 1-(2,3-dimethoxyphenyl)-N-[3-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]methanimine Openeye Name: N-(3-benzylsulfanyl-1,2,4-triazol-4-yl)-1-(2,3-dimethoxyphenyl)methanimine CAS Name: 1-(2,3-dimethoxyphenyl)-N-[3-(phenylmethylthio)-1,2,4-triazol-4-yl]methanimine IUPAC Name: N-(3-benzylsulfanyl-1,2,4-triazol-4-yl)-1-(2,3-dimethoxyphenyl)methanimine Traditional Name: (E)-[3-(benzylthio)-1,2,4-triazol-4-yl]-(2,3-dimethoxybenzylidene)amine Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C=NN2C=NN=C2SCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1OC)/C=N/N2C=NN=C2SCC3=CC=CC=C3

InChI

InChI=1S/C18H18N4O2S/c1-23-16-10-6-9-15(17(16)24-2)11-20-22-13-19-21-18(22)25-12-14-7-4-3-5-8-14/h3-11,13H,12H2,1-2H3/b20-11+