3-[(4-butoxyphenyl)methylsulfanyl]-5-ethyl-1H-1,2,4-triazole

Systemtic Name: 3-[(4-butoxyphenyl)methylsulfanyl]-5-ethyl-1H-1,2,4-triazole Openeye Name: 3-[(4-butoxyphenyl)methylsulfanyl]-5-ethyl-1H-1,2,4-triazole CAS Name: 3-[(4-butoxyphenyl)methylthio]-5-ethyl-1H-1,2,4-triazole IUPAC Name: 3-[(4-butoxyphenyl)methylsulfanyl]-5-ethyl-1H-1,2,4-triazole Traditional Name: 3-[(4-butoxybenzyl)thio]-5-ethyl-1H-1,2,4-triazole Formula: C15H21N3OS MolecularWeight: 291.41174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CSC2=NNC(=N2)CC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CSC2=NNC(=N2)CC

InChI

InChI=1S/C15H21N3OS/c1-3-5-10-19-13-8-6-12(7-9-13)11-20-15-16-14(4-2)17-18-15/h6-9H,3-5,10-11H2,1-2H3,(H,16,17,18)