3-[(4-methoxyphenoxy)methyl]-4-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-[(4-methoxyphenoxy)methyl]-4-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-5-[(4-methoxyphenoxy)methyl]-4-phenyl-1,2,4-triazole CAS Name: 3-[(4-methoxyphenoxy)methyl]-4-phenyl-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-[(4-methoxyphenoxy)methyl]-4-phenyl-1,2,4-triazole Traditional Name: 3-(benzylthio)-5-[(4-methoxyphenoxy)methyl]-4-phenyl-1,2,4-triazole Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC2=NN=C(N2C3=CC=CC=C3)SCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)OCC2=NN=C(N2C3=CC=CC=C3)SCC4=CC=CC=C4

InChI

InChI=1S/C23H21N3O2S/c1-27-20-12-14-21(15-13-20)28-16-22-24-25-23(26(22)19-10-6-3-7-11-19)29-17-18-8-4-2-5-9-18/h2-15H,16-17H2,1H3