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

Systemtic Name: N-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-1H-1,2,4-triazol-5-amine Openeye Name: N-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-1H-1,2,4-triazol-5-amine CAS Name: N-[(4-methoxyphenyl)methyl]-3-(methylthio)-1H-1,2,4-triazol-5-amine IUPAC Name: N-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-1H-1,2,4-triazol-5-amine Traditional Name: [3-(methylthio)-1H-1,2,4-triazol-5-yl]-p-anisyl-amine Formula: C11H14N4OS MolecularWeight: 250.32006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NC(=NN2)SC

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NC(=NN2)SC

InChI

InChI=1S/C11H14N4OS/c1-16-9-5-3-8(4-6-9)7-12-10-13-11(17-2)15-14-10/h3-6H,7H2,1-2H3,(H2,12,13,14,15)