ethyl 2-oxidanylidene-3-[1-(pyridin-3-ylcarbamothioyl)piperidin-4-yl]-1,3-oxazolidine-4-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-3-[1-(pyridin-3-ylcarbamothioyl)piperidin-4-yl]-1,3-oxazolidine-4-carboxylate Openeye Name: ethyl 2-oxo-3-[1-(3-pyridylcarbamothioyl)-4-piperidyl]oxazolidine-4-carboxylate CAS Name: 2-oxo-3-[1-[(3-pyridinylamino)-sulfanylidenemethyl]-4-piperidinyl]-4-oxazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-3-[1-(pyridin-3-ylcarbamothioyl)piperidin-4-yl]-1,3-oxazolidine-4-carboxylate Traditional Name: 2-keto-3-[1-(3-pyridylthiocarbamoyl)-4-piperidyl]oxazolidine-4-carboxylic acid ethyl ester Formula: C17H22N4O4S MolecularWeight: 378.44598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1COC(=O)N1C2CCN(CC2)C(=S)NC3=CN=CC=C3

Isomeric SMILES

CCOC(=O)C1COC(=O)N1C2CCN(CC2)C(=S)NC3=CN=CC=C3

InChI

InChI=1S/C17H22N4O4S/c1-2-24-15(22)14-11-25-17(23)21(14)13-5-8-20(9-6-13)16(26)19-12-4-3-7-18-10-12/h3-4,7,10,13-14H,2,5-6,8-9,11H2,1H3,(H,19,26)