5-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]-2,1,3-benzoxadiazole

Systemtic Name: 5-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]-2,1,3-benzoxadiazole Openeye Name: 5-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)-2,1,3-benzoxadiazole CAS Name: 5-[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]-2,1,3-benzoxadiazole IUPAC Name: 5-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)-2,1,3-benzoxadiazole Traditional Name: 5-[5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]benzofurazan Formula: C16H13N5OS MolecularWeight: 323.37232

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2)C3=CC4=NON=C4C=C3

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2)C3=CC4=NON=C4C=C3

InChI

InChI=1S/C16H13N5OS/c1-21-15(12-7-8-13-14(9-12)20-22-19-13)17-18-16(21)23-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3