1-[3-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]propyl]-4-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-[3-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]propyl]-4-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]-4-oxo-pyridine-3-carboxylic acid CAS Name: 1-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]-4-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]-4-oxopyridine-3-carboxylic acid Traditional Name: 1-[3-(1,1-diketo-1,4-thiazinan-4-yl)propyl]-4-keto-nicotinic acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCN1CCCN2C=CC(=O)C(=C2)C(=O)O

Isomeric SMILES

C1CS(=O)(=O)CCN1CCCN2C=CC(=O)C(=C2)C(=O)O

InChI

InChI=1S/C13H18N2O5S/c16-12-2-5-15(10-11(12)13(17)18)4-1-3-14-6-8-21(19,20)9-7-14/h2,5,10H,1,3-4,6-9H2,(H,17,18)