6-[[(1S)-1-(4-methylsulfonylphenyl)ethyl]carbamoyl]pyridazin-3-olate

Systemtic Name: 6-[[(1S)-1-(4-methylsulfonylphenyl)ethyl]carbamoyl]pyridazin-3-olate Openeye Name: 6-[[(1S)-1-(4-methylsulfonylphenyl)ethyl]carbamoyl]pyridazin-3-olate CAS Name: 6-[[[(1S)-1-(4-methylsulfonylphenyl)ethyl]amino]-oxomethyl]-3-pyridazinolate IUPAC Name: 6-[[(1S)-1-(4-methylsulfonylphenyl)ethyl]carbamoyl]pyridazin-3-olate Traditional Name: 6-[[(1S)-1-(4-mesylphenyl)ethyl]carbamoyl]pyridazin-3-olate Formula: C14H14N3O4S- MolecularWeight: 320.34366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)C2=NN=C(C=C2)[O-]

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)C2=NN=C(C=C2)[O-]

InChI

InChI=1S/C14H15N3O4S/c1-9(10-3-5-11(6-4-10)22(2,20)21)15-14(19)12-7-8-13(18)17-16-12/h3-9H,1-2H3,(H,15,19)(H,17,18)/p-1/t9-/m0/s1