2-[[4-methyl-5-(pyrimidin-2-ylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylphenyl)ethanamide

Systemtic Name: 2-[[4-methyl-5-(pyrimidin-2-ylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylphenyl)ethanamide Openeye Name: 2-[[4-methyl-5-(pyrimidin-2-ylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylphenyl)acetamide CAS Name: 2-[[4-methyl-5-[(2-pyrimidinylthio)methyl]-1,2,4-triazol-3-yl]thio]-N-(2-phenylphenyl)acetamide IUPAC Name: 2-[[4-methyl-5-(pyrimidin-2-ylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylphenyl)acetamide Traditional Name: 2-[[4-methyl-5-[(2-pyrimidylthio)methyl]-1,2,4-triazol-3-yl]thio]-N-(2-phenylphenyl)acetamide Formula: C22H20N6OS2 MolecularWeight: 448.5638

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C3=CC=CC=C3)CSC4=NC=CC=N4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C3=CC=CC=C3)CSC4=NC=CC=N4

InChI

InChI=1S/C22H20N6OS2/c1-28-19(14-30-21-23-12-7-13-24-21)26-27-22(28)31-15-20(29)25-18-11-6-5-10-17(18)16-8-3-2-4-9-16/h2-13H,14-15H2,1H3,(H,25,29)