4-methylsulfonyl-2-[[(E)-(1-oxidanylpyridin-2-ylidene)carbamoyl]amino]butanoic acid

Systemtic Name: 4-methylsulfonyl-2-[[(E)-(1-oxidanylpyridin-2-ylidene)carbamoyl]amino]butanoic acid Openeye Name: 2-[[(E)-(1-hydroxy-2-pyridylidene)carbamoyl]amino]-4-methylsulfonyl-butanoic acid CAS Name: 2-[[[(E)-(1-hydroxy-2-pyridinylidene)amino]-oxomethyl]amino]-4-methylsulfonylbutanoic acid IUPAC Name: 2-[[(E)-(1-hydroxypyridin-2-ylidene)carbamoyl]amino]-4-methylsulfonylbutanoic acid Traditional Name: 2-[[(E)-(1-hydroxy-2-pyridylidene)carbamoyl]amino]-4-mesyl-butyric acid Formula: C11H15N3O6S MolecularWeight: 317.3183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)O)NC(=O)N=C1C=CC=CN1O

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)O)NC(=O)/N=C/1\C=CC=CN1O

InChI

InChI=1S/C11H15N3O6S/c1-21(19,20)7-5-8(10(15)16)12-11(17)13-9-4-2-3-6-14(9)18/h2-4,6,8,18H,5,7H2,1H3,(H,12,17)(H,15,16)/b13-9+