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

Systemtic Name: 2-[[5-(2-hydroxyethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-5-methyl-benzene-1,4-diol Openeye Name: 2-[[5-(2-hydroxyethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-5-methyl-benzene-1,4-diol CAS Name: 2-[[5-(2-hydroxyethyl)-1H-1,2,4-triazol-3-yl]thio]-5-methylbenzene-1,4-diol IUPAC Name: 2-[[5-(2-hydroxyethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-5-methylbenzene-1,4-diol Traditional Name: 2-[[5-(2-hydroxyethyl)-1H-1,2,4-triazol-3-yl]thio]-5-methyl-hydroquinone Formula: C11H13N3O3S MolecularWeight: 267.30422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1O)SC2=NNC(=N2)CCO)O

Isomeric SMILES

CC1=CC(=C(C=C1O)SC2=NNC(=N2)CCO)O

InChI

InChI=1S/C11H13N3O3S/c1-6-4-8(17)9(5-7(6)16)18-11-12-10(2-3-15)13-14-11/h4-5,15-17H,2-3H2,1H3,(H,12,13,14)