3-[(2-methoxyphenyl)methylsulfanyl]-N-[(E)-1-phenylethylideneamino]-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[(2-methoxyphenyl)methylsulfanyl]-N-[(E)-1-phenylethylideneamino]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[(2-methoxyphenyl)methylsulfanyl]-N-[(E)-1-phenylethylideneamino]-1H-1,2,4-triazol-5-amine CAS Name: 3-[(2-methoxyphenyl)methylthio]-N-[(E)-1-phenylethylideneamino]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[(2-methoxyphenyl)methylsulfanyl]-N-[(E)-1-phenylethylideneamino]-1H-1,2,4-triazol-5-amine Traditional Name: [3-(o-anisylthio)-1H-1,2,4-triazol-5-yl]-[(E)-1-phenylethylideneamino]amine Formula: C18H19N5OS MolecularWeight: 353.44136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC(=NN1)SCC2=CC=CC=C2OC)C3=CC=CC=C3

Isomeric SMILES

C/C(=N\NC1=NC(=NN1)SCC2=CC=CC=C2OC)/C3=CC=CC=C3

InChI

InChI=1S/C18H19N5OS/c1-13(14-8-4-3-5-9-14)20-21-17-19-18(23-22-17)25-12-15-10-6-7-11-16(15)24-2/h3-11H,12H2,1-2H3,(H2,19,21,22,23)/b20-13+