4-[5-(2,4-dimethylphenyl)-4-sulfanyl-1,2,3-triazol-1-yl]benzene-1,3-diol

Systemtic Name: 4-[5-(2,4-dimethylphenyl)-4-sulfanyl-1,2,3-triazol-1-yl]benzene-1,3-diol Openeye Name: 4-[5-(2,4-dimethylphenyl)-4-sulfanyl-triazol-1-yl]benzene-1,3-diol CAS Name: 4-[5-(2,4-dimethylphenyl)-4-mercapto-1-triazolyl]benzene-1,3-diol IUPAC Name: 4-[5-(2,4-dimethylphenyl)-4-sulfanyltriazol-1-yl]benzene-1,3-diol Traditional Name: 4-[5-(2,4-dimethylphenyl)-4-mercapto-triazol-1-yl]resorcinol Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(N=NN2C3=C(C=C(C=C3)O)O)S)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(N=NN2C3=C(C=C(C=C3)O)O)S)C

InChI

InChI=1S/C16H15N3O2S/c1-9-3-5-12(10(2)7-9)15-16(22)17-18-19(15)13-6-4-11(20)8-14(13)21/h3-8,20-22H,1-2H3