5-methoxy-1-phenyl-3-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 5-methoxy-1-phenyl-3-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-5-methoxy-1-phenyl-1,2,4-triazole CAS Name: 5-methoxy-1-phenyl-3-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-methoxy-1-phenyl-1,2,4-triazole Traditional Name: 3-(benzylthio)-5-methoxy-1-phenyl-1,2,4-triazole Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NN1C2=CC=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

COC1=NC(=NN1C2=CC=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C16H15N3OS/c1-20-16-17-15(21-12-13-8-4-2-5-9-13)18-19(16)14-10-6-3-7-11-14/h2-11H,12H2,1H3