2-methyl-6-[methyl(thiolan-3-yl)carbamoyl]pyridine-3-carboxylic acid

Systemtic Name: 2-methyl-6-[methyl(thiolan-3-yl)carbamoyl]pyridine-3-carboxylic acid Openeye Name: 2-methyl-6-[methyl(tetrahydrothiophen-3-yl)carbamoyl]pyridine-3-carboxylic acid CAS Name: 2-methyl-6-[[methyl(3-thiolanyl)amino]-oxomethyl]-3-pyridinecarboxylic acid IUPAC Name: 2-methyl-6-[methyl(thiolan-3-yl)carbamoyl]pyridine-3-carboxylic acid Traditional Name: 2-methyl-6-[methyl(tetrahydrothiophen-3-yl)carbamoyl]nicotinic acid Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C(=O)N(C)C2CCSC2)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=N1)C(=O)N(C)C2CCSC2)C(=O)O

InChI

InChI=1S/C13H16N2O3S/c1-8-10(13(17)18)3-4-11(14-8)12(16)15(2)9-5-6-19-7-9/h3-4,9H,5-7H2,1-2H3,(H,17,18)