4-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]benzene-1,2-diol

Systemtic Name: 4-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]benzene-1,2-diol Openeye Name: 4-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]benzene-1,2-diol CAS Name: 4-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)thio]benzene-1,2-diol IUPAC Name: 4-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]benzene-1,2-diol Traditional Name: 4-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)thio]pyrocatechol Formula: C12H10N4O2S MolecularWeight: 274.2984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=NC=NN2C(=C1)SC3=CC(=C(C=C3)O)O

Isomeric SMILES

CC1=NC2=NC=NN2C(=C1)SC3=CC(=C(C=C3)O)O

InChI

InChI=1S/C12H10N4O2S/c1-7-4-11(16-12(15-7)13-6-14-16)19-8-2-3-9(17)10(18)5-8/h2-6,17-18H,1H3