[1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [2-(2-furylmethylamino)-1-methyl-2-oxo-ethyl] 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [1-(2-furanylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(furan-2-ylmethylamino)-1-oxopropan-2-yl] 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [2-(2-furfurylamino)-2-keto-1-methyl-ethyl] ester Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)OC(=O)C2=C(N=CC=C2)SC

Isomeric SMILES

CC(C(=O)NCC1=CC=CO1)OC(=O)C2=C(N=CC=C2)SC

InChI

InChI=1S/C15H16N2O4S/c1-10(13(18)17-9-11-5-4-8-20-11)21-15(19)12-6-3-7-16-14(12)22-2/h3-8,10H,9H2,1-2H3,(H,17,18)