methyl 2-[[1-(4-bromophenyl)carbonylpiperidin-4-yl]carbonylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[[1-(4-bromophenyl)carbonylpiperidin-4-yl]carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[1-(4-bromobenzoyl)piperidine-4-carbonyl]amino]thiazole-5-carboxylate CAS Name: 2-[[[1-[(4-bromophenyl)-oxomethyl]-4-piperidinyl]-oxomethyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[1-(4-bromobenzoyl)piperidine-4-carbonyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[[1-(4-bromobenzoyl)isonipecotoyl]amino]thiazole-5-carboxylic acid methyl ester Formula: C18H18BrN3O4S MolecularWeight: 452.32222

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(S1)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC(=O)C1=CN=C(S1)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H18BrN3O4S/c1-26-17(25)14-10-20-18(27-14)21-15(23)11-6-8-22(9-7-11)16(24)12-2-4-13(19)5-3-12/h2-5,10-11H,6-9H2,1H3,(H,20,21,23)