3-[(4-tert-butylphenyl)methylsulfanyl]-4-ethyl-5-(furan-2-yl)-1,2,4-triazole

Systemtic Name: 3-[(4-tert-butylphenyl)methylsulfanyl]-4-ethyl-5-(furan-2-yl)-1,2,4-triazole Openeye Name: 3-[(4-tert-butylphenyl)methylsulfanyl]-4-ethyl-5-(2-furyl)-1,2,4-triazole CAS Name: 3-[(4-tert-butylphenyl)methylthio]-4-ethyl-5-(2-furanyl)-1,2,4-triazole IUPAC Name: 3-[(4-tert-butylphenyl)methylsulfanyl]-4-ethyl-5-(furan-2-yl)-1,2,4-triazole Traditional Name: 3-[(4-tert-butylbenzyl)thio]-4-ethyl-5-(2-furyl)-1,2,4-triazole Formula: C19H23N3OS MolecularWeight: 341.47042

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)C(C)(C)C)C3=CC=CO3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)C(C)(C)C)C3=CC=CO3

InChI

InChI=1S/C19H23N3OS/c1-5-22-17(16-7-6-12-23-16)20-21-18(22)24-13-14-8-10-15(11-9-14)19(2,3)4/h6-12H,5,13H2,1-4H3