5-[(3,4-dimethylphenoxy)methyl]-2-(hydroxymethyl)-4-phenyl-1,2,4-triazole-3-thione

Systemtic Name: 5-[(3,4-dimethylphenoxy)methyl]-2-(hydroxymethyl)-4-phenyl-1,2,4-triazole-3-thione Openeye Name: 5-[(3,4-dimethylphenoxy)methyl]-2-(hydroxymethyl)-4-phenyl-1,2,4-triazole-3-thione CAS Name: 5-[(3,4-dimethylphenoxy)methyl]-2-(hydroxymethyl)-4-phenyl-1,2,4-triazole-3-thione IUPAC Name: 5-[(3,4-dimethylphenoxy)methyl]-2-(hydroxymethyl)-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 5-[(3,4-dimethylphenoxy)methyl]-2-methylol-4-phenyl-1,2,4-triazole-3-thione Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC2=NN(C(=S)N2C3=CC=CC=C3)CO)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC2=NN(C(=S)N2C3=CC=CC=C3)CO)C

InChI

InChI=1S/C18H19N3O2S/c1-13-8-9-16(10-14(13)2)23-11-17-19-20(12-22)18(24)21(17)15-6-4-3-5-7-15/h3-10,22H,11-12H2,1-2H3