[1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl] 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate

Systemtic Name: [1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl] 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Openeye Name: [1-methyl-2-(4-methyl-1-piperidyl)-2-oxo-ethyl] 4-(thiazol-4-ylmethylsulfanyl)benzoate CAS Name: 4-(4-thiazolylmethylthio)benzoic acid [1-(4-methyl-1-piperidinyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl] 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Traditional Name: 4-(thiazol-4-ylmethylthio)benzoic acid [2-keto-1-methyl-2-(4-methylpiperidino)ethyl] ester Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(C)OC(=O)C2=CC=C(C=C2)SCC3=CSC=N3

Isomeric SMILES

CC1CCN(CC1)C(=O)C(C)OC(=O)C2=CC=C(C=C2)SCC3=CSC=N3

InChI

InChI=1S/C20H24N2O3S2/c1-14-7-9-22(10-8-14)19(23)15(2)25-20(24)16-3-5-18(6-4-16)27-12-17-11-26-13-21-17/h3-6,11,13-15H,7-10,12H2,1-2H3