methyl 2-[[(4-bromophenyl)sulfonyl-pentyl-amino]methyl]-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 2-[[(4-bromophenyl)sulfonyl-pentyl-amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[(4-bromophenyl)sulfonyl-pentyl-amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[(4-bromophenyl)sulfonyl-pentylamino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-bromophenyl)sulfonyl-pentylamino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[amyl(brosyl)amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C17H21BrN2O5S MolecularWeight: 445.32804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=NC(=CO1)C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCN(CC1=NC(=CO1)C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H21BrN2O5S/c1-3-4-5-10-20(11-16-19-15(12-25-16)17(21)24-2)26(22,23)14-8-6-13(18)7-9-14/h6-9,12H,3-5,10-11H2,1-2H3