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

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-benzylsulfanyl-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine CAS Name: 3-[(4-methoxyphenyl)methyl]-5-(phenylmethylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-benzylsulfanyl-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine Traditional Name: [3-(benzylthio)-5-p-anisyl-1,2,4-triazol-4-yl]amine Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NN=C(N2N)SCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NN=C(N2N)SCC3=CC=CC=C3

InChI

InChI=1S/C17H18N4OS/c1-22-15-9-7-13(8-10-15)11-16-19-20-17(21(16)18)23-12-14-5-3-2-4-6-14/h2-10H,11-12,18H2,1H3