ethyl 5-[2-[1-(furan-2-ylmethylcarbamothioyl)piperidin-4-yl]-1,3-thiazol-4-yl]-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 5-[2-[1-(furan-2-ylmethylcarbamothioyl)piperidin-4-yl]-1,3-thiazol-4-yl]-1,2-oxazole-3-carboxylate Openeye Name: ethyl 5-[2-[1-(2-furylmethylcarbamothioyl)-4-piperidyl]thiazol-4-yl]isoxazole-3-carboxylate CAS Name: 5-[2-[1-[(2-furanylmethylamino)-sulfanylidenemethyl]-4-piperidinyl]-4-thiazolyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[1-(furan-2-ylmethylcarbamothioyl)piperidin-4-yl]-1,3-thiazol-4-yl]-1,2-oxazole-3-carboxylate Traditional Name: 5-[2-[1-(2-furfurylthiocarbamoyl)-4-piperidyl]thiazol-4-yl]isoxazole-3-carboxylic acid ethyl ester Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1)C2=CSC(=N2)C3CCN(CC3)C(=S)NCC4=CC=CO4

Isomeric SMILES

CCOC(=O)C1=NOC(=C1)C2=CSC(=N2)C3CCN(CC3)C(=S)NCC4=CC=CO4

InChI

InChI=1S/C20H22N4O4S2/c1-2-26-19(25)15-10-17(28-23-15)16-12-30-18(22-16)13-5-7-24(8-6-13)20(29)21-11-14-4-3-9-27-14/h3-4,9-10,12-13H,2,5-8,11H2,1H3,(H,21,29)