2-(4-methylphthalazin-1-yl)sulfanylethanoate

Systemtic Name: 2-(4-methylphthalazin-1-yl)sulfanylethanoate Openeye Name: 2-(4-methylphthalazin-1-yl)sulfanylacetate CAS Name: 2-[(4-methyl-1-phthalazinyl)thio]acetate IUPAC Name: 2-(4-methylphthalazin-1-yl)sulfanylacetate Traditional Name: 2-[(4-methylphthalazin-1-yl)thio]acetate Formula: C11H9N2O2S- MolecularWeight: 233.26636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C2=CC=CC=C12)SCC(=O)[O-]

Isomeric SMILES

CC1=NN=C(C2=CC=CC=C12)SCC(=O)[O-]

InChI

InChI=1S/C11H10N2O2S/c1-7-8-4-2-3-5-9(8)11(13-12-7)16-6-10(14)15/h2-5H,6H2,1H3,(H,14,15)/p-1