2-[2-(3-methylthiolan-2-yl)ethanoylamino]pyridine-3-carboxylic acid

Systemtic Name: 2-[2-(3-methylthiolan-2-yl)ethanoylamino]pyridine-3-carboxylic acid Openeye Name: 2-[[2-(3-methyltetrahydrothiophen-2-yl)acetyl]amino]pyridine-3-carboxylic acid CAS Name: 2-[[2-(3-methyl-2-thiolanyl)-1-oxoethyl]amino]-3-pyridinecarboxylic acid IUPAC Name: 2-[[2-(3-methylthiolan-2-yl)acetyl]amino]pyridine-3-carboxylic acid Traditional Name: 2-[[2-(3-methyltetrahydrothiophen-2-yl)acetyl]amino]nicotinic acid Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCSC1CC(=O)NC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CC1CCSC1CC(=O)NC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C13H16N2O3S/c1-8-4-6-19-10(8)7-11(16)15-12-9(13(17)18)3-2-5-14-12/h2-3,5,8,10H,4,6-7H2,1H3,(H,17,18)(H,14,15,16)