2-[2-[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]ethanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[2-[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]ethanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[2-(3,6-dioxo-1H-pyridazin-2-yl)acetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-(3,6-dioxo-1H-pyridazin-2-yl)-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[2-(3,6-dioxo-1H-pyridazin-2-yl)acetyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[2-(3,6-diketo-1H-pyridazin-2-yl)acetyl]amino]-4-(methylthio)butyric acid Formula: C11H15N3O5S MolecularWeight: 301.3189

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)CN1C(=O)C=CC(=O)N1

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)CN1C(=O)C=CC(=O)N1

InChI

InChI=1S/C11H15N3O5S/c1-20-5-4-7(11(18)19)12-9(16)6-14-10(17)3-2-8(15)13-14/h2-3,7H,4-6H2,1H3,(H,12,16)(H,13,15)(H,18,19)