methyl 2-[[(4-bromophenyl)carbonyl-cyclohexyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[(4-bromophenyl)carbonyl-cyclohexyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(4-bromobenzoyl)-cyclohexyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(4-bromophenyl)-oxomethyl]-cyclohexylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-bromobenzoyl)-cyclohexylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(4-bromobenzoyl)-cyclohexyl-amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC(=N1)CN(C2CCCCC2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC(=O)C1=CSC(=N1)CN(C2CCCCC2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H21BrN2O3S/c1-25-19(24)16-12-26-17(21-16)11-22(15-5-3-2-4-6-15)18(23)13-7-9-14(20)10-8-13/h7-10,12,15H,2-6,11H2,1H3