3-(3,4-dimethoxyphenyl)-5-phenethylsulfanyl-4-phenyl-1,2,4-triazole

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-phenethylsulfanyl-4-phenyl-1,2,4-triazole Openeye Name: 3-(3,4-dimethoxyphenyl)-5-phenethylsulfanyl-4-phenyl-1,2,4-triazole CAS Name: 3-(3,4-dimethoxyphenyl)-5-(phenethylthio)-4-phenyl-1,2,4-triazole IUPAC Name: 3-(3,4-dimethoxyphenyl)-5-phenethylsulfanyl-4-phenyl-1,2,4-triazole Traditional Name: 3-(3,4-dimethoxyphenyl)-5-(phenethylthio)-4-phenyl-1,2,4-triazole Formula: C24H23N3O2S MolecularWeight: 417.52332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCCC4=CC=CC=C4)OC

InChI

InChI=1S/C24H23N3O2S/c1-28-21-14-13-19(17-22(21)29-2)23-25-26-24(27(23)20-11-7-4-8-12-20)30-16-15-18-9-5-3-6-10-18/h3-14,17H,15-16H2,1-2H3