3-[(3-methoxyphenoxy)methyl]-5-[(4-phenylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[(3-methoxyphenoxy)methyl]-5-[(4-phenylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(3-methoxyphenoxy)methyl]-5-[(4-phenylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(3-methoxyphenoxy)methyl]-5-[(4-phenylphenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-methoxyphenoxy)methyl]-5-[(4-phenylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(3-methoxyphenoxy)methyl]-5-[(4-phenylbenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)OCC2=NN=C(N2N)SCC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC=C1)OCC2=NN=C(N2N)SCC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H22N4O2S/c1-28-20-8-5-9-21(14-20)29-15-22-25-26-23(27(22)24)30-16-17-10-12-19(13-11-17)18-6-3-2-4-7-18/h2-14H,15-16,24H2,1H3