(2-ethyl-1,3-thiazol-4-yl)methyl 1-(4-bromophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: (2-ethyl-1,3-thiazol-4-yl)methyl 1-(4-bromophenyl)carbonylpiperidine-4-carboxylate Openeye Name: (2-ethylthiazol-4-yl)methyl 1-(4-bromobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-bromophenyl)-oxomethyl]-4-piperidinecarboxylic acid (2-ethyl-4-thiazolyl)methyl ester IUPAC Name: (2-ethyl-1,3-thiazol-4-yl)methyl 1-(4-bromobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-bromobenzoyl)isonipecotic acid (2-ethylthiazol-4-yl)methyl ester Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)COC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC1=NC(=CS1)COC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H21BrN2O3S/c1-2-17-21-16(12-26-17)11-25-19(24)14-7-9-22(10-8-14)18(23)13-3-5-15(20)6-4-13/h3-6,12,14H,2,7-11H2,1H3