4-ethyl-3-(phenoxymethyl)-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-ethyl-3-(phenoxymethyl)-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-4-ethyl-5-(phenoxymethyl)-1,2,4-triazole CAS Name: 4-ethyl-3-(phenoxymethyl)-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-4-ethyl-5-(phenoxymethyl)-1,2,4-triazole Traditional Name: 3-(benzylthio)-4-ethyl-5-(phenoxymethyl)-1,2,4-triazole Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC=C2)COC3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC=C2)COC3=CC=CC=C3

InChI

InChI=1S/C18H19N3OS/c1-2-21-17(13-22-16-11-7-4-8-12-16)19-20-18(21)23-14-15-9-5-3-6-10-15/h3-12H,2,13-14H2,1H3