methyl 1-[2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]ethanoylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]ethanoylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[2-[2-(3-bromophenyl)thiazol-4-yl]acetyl]amino]cyclohexanecarboxylate CAS Name: 1-[[2-[2-(3-bromophenyl)-4-thiazolyl]-1-oxoethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]acetyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[2-[2-(3-bromophenyl)thiazol-4-yl]acetyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)CC2=CSC(=N2)C3=CC(=CC=C3)Br

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)CC2=CSC(=N2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H21BrN2O3S/c1-25-18(24)19(8-3-2-4-9-19)22-16(23)11-15-12-26-17(21-15)13-6-5-7-14(20)10-13/h5-7,10,12H,2-4,8-9,11H2,1H3,(H,22,23)