6-[2-(4-methylphenyl)sulfanylethylcarbamoyl]pyridazin-3-olate

Systemtic Name: 6-[2-(4-methylphenyl)sulfanylethylcarbamoyl]pyridazin-3-olate Openeye Name: 6-[2-(p-tolylsulfanyl)ethylcarbamoyl]pyridazin-3-olate CAS Name: 6-[[2-[(4-methylphenyl)thio]ethylamino]-oxomethyl]-3-pyridazinolate IUPAC Name: 6-[2-(4-methylphenyl)sulfanylethylcarbamoyl]pyridazin-3-olate Traditional Name: 6-[2-(p-tolylthio)ethylcarbamoyl]pyridazin-3-olate Formula: C14H14N3O2S- MolecularWeight: 288.34486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=NN=C(C=C2)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=NN=C(C=C2)[O-]

InChI

InChI=1S/C14H15N3O2S/c1-10-2-4-11(5-3-10)20-9-8-15-14(19)12-6-7-13(18)17-16-12/h2-7H,8-9H2,1H3,(H,15,19)(H,17,18)/p-1