2-[(3,4-dimethyl-6-oxidanylidene-1H-pyridazin-5-yl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(3,4-dimethyl-6-oxidanylidene-1H-pyridazin-5-yl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(3,4-dimethyl-6-oxo-1H-pyridazine-5-carbonyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(3,4-dimethyl-6-oxo-1H-pyridazin-5-yl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(3,4-dimethyl-6-oxo-1H-pyridazine-5-carbonyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(6-keto-3,4-dimethyl-1H-pyridazine-5-carbonyl)amino]-4-(methylthio)butyric acid Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN=C1C)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CC1=C(C(=O)NN=C1C)C(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C12H17N3O4S/c1-6-7(2)14-15-11(17)9(6)10(16)13-8(12(18)19)4-5-20-3/h8H,4-5H2,1-3H3,(H,13,16)(H,15,17)(H,18,19)