3-[2-(3,4-dimethoxyphenyl)ethyl]-4-propan-2-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-propan-2-yl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-isopropyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-propan-2-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-propan-2-yl-1H-1,2,4-triazole-5-thione Traditional Name: 3-homoveratryl-4-isopropyl-1H-1,2,4-triazole-5-thione Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NNC1=S)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)N1C(=NNC1=S)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C15H21N3O2S/c1-10(2)18-14(16-17-15(18)21)8-6-11-5-7-12(19-3)13(9-11)20-4/h5,7,9-10H,6,8H2,1-4H3,(H,17,21)