ethyl 5-[2-[1-(2-methylsulfonylphenyl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 5-[2-[1-(2-methylsulfonylphenyl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]-1,2-oxazole-3-carboxylate Openeye Name: ethyl 5-[2-[1-(2-methylsulfonylbenzoyl)-4-piperidyl]thiazol-4-yl]isoxazole-3-carboxylate CAS Name: 5-[2-[1-[(2-methylsulfonylphenyl)-oxomethyl]-4-piperidinyl]-4-thiazolyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[1-(2-methylsulfonylbenzoyl)piperidin-4-yl]-1,3-thiazol-4-yl]-1,2-oxazole-3-carboxylate Traditional Name: 5-[2-[1-(2-mesylbenzoyl)-4-piperidyl]thiazol-4-yl]isoxazole-3-carboxylic acid ethyl ester Formula: C22H23N3O6S2 MolecularWeight: 489.56452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=CC=CC=C4S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=NOC(=C1)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=CC=CC=C4S(=O)(=O)C

InChI

InChI=1S/C22H23N3O6S2/c1-3-30-22(27)16-12-18(31-24-16)17-13-32-20(23-17)14-8-10-25(11-9-14)21(26)15-6-4-5-7-19(15)33(2,28)29/h4-7,12-14H,3,8-11H2,1-2H3