N-[(E)-1-(3-methoxyphenyl)ethylideneamino]-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazol-5-amine

Systemtic Name: N-[(E)-1-(3-methoxyphenyl)ethylideneamino]-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazol-5-amine Openeye Name: N-[(E)-1-(3-methoxyphenyl)ethylideneamino]-3-(4-pyridylmethylsulfanyl)-1H-1,2,4-triazol-5-amine CAS Name: N-[(E)-1-(3-methoxyphenyl)ethylideneamino]-3-(pyridin-4-ylmethylthio)-1H-1,2,4-triazol-5-amine IUPAC Name: N-[(E)-1-(3-methoxyphenyl)ethylideneamino]-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazol-5-amine Traditional Name: [(E)-1-(3-methoxyphenyl)ethylideneamino]-[3-(4-pyridylmethylthio)-1H-1,2,4-triazol-5-yl]amine Formula: C17H18N6OS MolecularWeight: 354.42942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC(=NN1)SCC2=CC=NC=C2)C3=CC(=CC=C3)OC

Isomeric SMILES

C/C(=N\NC1=NC(=NN1)SCC2=CC=NC=C2)/C3=CC(=CC=C3)OC

InChI

InChI=1S/C17H18N6OS/c1-12(14-4-3-5-15(10-14)24-2)20-21-16-19-17(23-22-16)25-11-13-6-8-18-9-7-13/h3-10H,11H2,1-2H3,(H2,19,21,22,23)/b20-12+