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

Systemtic Name: 4-ethyl-3-(4-methoxyphenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazole CAS Name: 4-ethyl-3-(4-methoxyphenyl)-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazole Traditional Name: 3-(benzylthio)-4-ethyl-5-(4-methoxyphenyl)-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)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H19N3OS/c1-3-21-17(15-9-11-16(22-2)12-10-15)19-20-18(21)23-13-14-7-5-4-6-8-14/h4-12H,3,13H2,1-2H3