6-[(5-methylpyridin-2-yl)carbamoyl]-2,3-dihydro-1,4-dithiine-5-carboxylic acid

Systemtic Name: 6-[(5-methylpyridin-2-yl)carbamoyl]-2,3-dihydro-1,4-dithiine-5-carboxylic acid Openeye Name: 6-[(5-methyl-2-pyridyl)carbamoyl]-2,3-dihydro-1,4-dithiine-5-carboxylic acid CAS Name: 6-[[(5-methyl-2-pyridinyl)amino]-oxomethyl]-2,3-dihydro-1,4-dithiin-5-carboxylic acid IUPAC Name: 6-[(5-methylpyridin-2-yl)carbamoyl]-2,3-dihydro-1,4-dithiine-5-carboxylic acid Traditional Name: 6-[(5-methyl-2-pyridyl)carbamoyl]-2,3-dihydro-1,4-dithiin-5-carboxylic acid Formula: C12H12N2O3S2 MolecularWeight: 296.36528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)NC(=O)C2=C(SCCS2)C(=O)O

Isomeric SMILES

CC1=CN=C(C=C1)NC(=O)C2=C(SCCS2)C(=O)O

InChI

InChI=1S/C12H12N2O3S2/c1-7-2-3-8(13-6-7)14-11(15)9-10(12(16)17)19-5-4-18-9/h2-3,6H,4-5H2,1H3,(H,16,17)(H,13,14,15)