N-[[4-(3-methoxyphenyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]-2-pyridin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[[4-(3-methoxyphenyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]-2-pyridin-2-ylsulfanyl-ethanamide Openeye Name: N-[[4-(3-methoxyphenyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]-2-(2-pyridylsulfanyl)acetamide CAS Name: N-[[4-(3-methoxyphenyl)-5-(phenethylthio)-1,2,4-triazol-3-yl]methyl]-2-(2-pyridinylthio)acetamide IUPAC Name: N-[[4-(3-methoxyphenyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]-2-pyridin-2-ylsulfanylacetamide Traditional Name: N-[[4-(3-methoxyphenyl)-5-(phenethylthio)-1,2,4-triazol-3-yl]methyl]-2-(2-pyridylthio)acetamide Formula: C25H25N5O2S2 MolecularWeight: 491.6283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=NN=C2SCCC3=CC=CC=C3)CNC(=O)CSC4=CC=CC=N4

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=NN=C2SCCC3=CC=CC=C3)CNC(=O)CSC4=CC=CC=N4

InChI

InChI=1S/C25H25N5O2S2/c1-32-21-11-7-10-20(16-21)30-22(17-27-23(31)18-34-24-12-5-6-14-26-24)28-29-25(30)33-15-13-19-8-3-2-4-9-19/h2-12,14,16H,13,15,17-18H2,1H3,(H,27,31)