3-[(3-butoxyphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(3-butoxyphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(3-butoxyphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(3-butoxyphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(3-butoxyphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(3-butoxyphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)OCC2=NNC(=S)N2C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)OCC2=NNC(=S)N2C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O2S/c1-2-3-12-23-16-10-7-11-17(13-16)24-14-18-20-21-19(25)22(18)15-8-5-4-6-9-15/h4-11,13H,2-3,12,14H2,1H3,(H,21,25)