3-[2-(2-methylphenoxy)ethylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine

Systemtic Name: 3-[2-(2-methylphenoxy)ethylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine Openeye Name: 3-[2-(2-methylphenoxy)ethylsulfanyl]-5-(3-pyridyl)-1,2,4-triazol-4-amine CAS Name: 3-[2-(2-methylphenoxy)ethylthio]-5-(3-pyridinyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(2-methylphenoxy)ethylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine Traditional Name: [3-[2-(2-methylphenoxy)ethylthio]-5-(3-pyridyl)-1,2,4-triazol-4-yl]amine Formula: C16H17N5OS MolecularWeight: 327.40408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCSC2=NN=C(N2N)C3=CN=CC=C3

Isomeric SMILES

CC1=CC=CC=C1OCCSC2=NN=C(N2N)C3=CN=CC=C3

InChI

InChI=1S/C16H17N5OS/c1-12-5-2-3-7-14(12)22-9-10-23-16-20-19-15(21(16)17)13-6-4-8-18-11-13/h2-8,11H,9-10,17H2,1H3