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

Systemtic Name: 4-methylsulfanyl-2-[(6-oxidanylidene-1H-pyridazin-3-yl)carbonylamino]butanoic acid Openeye Name: 4-methylsulfanyl-2-[(6-oxo-1H-pyridazine-3-carbonyl)amino]butanoic acid CAS Name: 4-(methylthio)-2-[[oxo-(6-oxo-1H-pyridazin-3-yl)methyl]amino]butanoic acid IUPAC Name: 4-methylsulfanyl-2-[(6-oxo-1H-pyridazine-3-carbonyl)amino]butanoic acid Traditional Name: 2-[(6-keto-1H-pyridazine-3-carbonyl)amino]-4-(methylthio)butyric acid Formula: C10H13N3O4S MolecularWeight: 271.29292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1=NNC(=O)C=C1

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)C1=NNC(=O)C=C1

InChI

InChI=1S/C10H13N3O4S/c1-18-5-4-7(10(16)17)11-9(15)6-2-3-8(14)13-12-6/h2-3,7H,4-5H2,1H3,(H,11,15)(H,13,14)(H,16,17)