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

Systemtic Name: 4-(4-ethoxyphenyl)-3-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-(4-ethoxyphenyl)-3-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 4-(4-ethoxyphenyl)-3-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-(4-ethoxyphenyl)-3-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(m-anisylthio)-5-(4-methoxyphenyl)-4-p-phenetyl-1,2,4-triazole Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O3S/c1-4-31-22-14-10-20(11-15-22)28-24(19-8-12-21(29-2)13-9-19)26-27-25(28)32-17-18-6-5-7-23(16-18)30-3/h5-16H,4,17H2,1-3H3