3-[(4-methoxyphenyl)methyl]-5-(2-pyridin-2-ylethylsulfanyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-5-(2-pyridin-2-ylethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(4-methoxyphenyl)methyl]-5-[2-(2-pyridyl)ethylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(4-methoxyphenyl)methyl]-5-[2-(2-pyridinyl)ethylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-methoxyphenyl)methyl]-5-(2-pyridin-2-ylethylsulfanyl)-1,2,4-triazol-4-amine Traditional Name: [3-p-anisyl-5-[2-(2-pyridyl)ethylthio]-1,2,4-triazol-4-yl]amine Formula: C17H19N5OS MolecularWeight: 341.43066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NN=C(N2N)SCCC3=CC=CC=N3

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NN=C(N2N)SCCC3=CC=CC=N3

InChI

InChI=1S/C17H19N5OS/c1-23-15-7-5-13(6-8-15)12-16-20-21-17(22(16)18)24-11-9-14-4-2-3-10-19-14/h2-8,10H,9,11-12,18H2,1H3