3-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]-4-methyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]-4-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[5-[(3,5-dimethylphenoxy)methyl]-2-furyl]-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[5-[(3,5-dimethylphenoxy)methyl]-2-furanyl]-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[5-[(3,5-dimethylphenoxy)methyl]-2-furyl]-4-methyl-1H-1,2,4-triazole-5-thione Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC2=CC=C(O2)C3=NNC(=S)N3C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC2=CC=C(O2)C3=NNC(=S)N3C)C

InChI

InChI=1S/C16H17N3O2S/c1-10-6-11(2)8-13(7-10)20-9-12-4-5-14(21-12)15-17-18-16(22)19(15)3/h4-8H,9H2,1-3H3,(H,18,22)