4-(4-ethoxyphenyl)-3-[(4-methoxyphenyl)methylsulfanyl]-5-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 4-(4-ethoxyphenyl)-3-[(4-methoxyphenyl)methylsulfanyl]-5-(phenylmethyl)-1,2,4-triazole Openeye Name: 3-benzyl-4-(4-ethoxyphenyl)-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 4-(4-ethoxyphenyl)-3-[(4-methoxyphenyl)methylthio]-5-(phenylmethyl)-1,2,4-triazole IUPAC Name: 3-benzyl-4-(4-ethoxyphenyl)-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-benzyl-5-(p-anisylthio)-4-p-phenetyl-1,2,4-triazole Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)OC)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)OC)CC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O2S/c1-3-30-23-15-11-21(12-16-23)28-24(17-19-7-5-4-6-8-19)26-27-25(28)31-18-20-9-13-22(29-2)14-10-20/h4-16H,3,17-18H2,1-2H3