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

Systemtic Name: 4-(4-ethoxyphenyl)-3-(3-methylphenyl)-5-[(3-phenoxyphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-(4-ethoxyphenyl)-3-(m-tolyl)-5-[(3-phenoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 4-(4-ethoxyphenyl)-3-(3-methylphenyl)-5-[(3-phenoxyphenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-(4-ethoxyphenyl)-3-(3-methylphenyl)-5-[(3-phenoxyphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(m-tolyl)-5-[(3-phenoxybenzyl)thio]-4-p-phenetyl-1,2,4-triazole Formula: C30H27N3O2S MolecularWeight: 493.61928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)OC4=CC=CC=C4)C5=CC(=CC=C5)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)OC4=CC=CC=C4)C5=CC(=CC=C5)C

InChI

InChI=1S/C30H27N3O2S/c1-3-34-26-17-15-25(16-18-26)33-29(24-11-7-9-22(2)19-24)31-32-30(33)36-21-23-10-8-14-28(20-23)35-27-12-5-4-6-13-27/h4-20H,3,21H2,1-2H3