ethyl 4-[2-[(4-bromophenyl)sulfonyl-methyl-amino]ethanoyl]thiomorpholine-3-carboxylate

Systemtic Name: ethyl 4-[2-[(4-bromophenyl)sulfonyl-methyl-amino]ethanoyl]thiomorpholine-3-carboxylate Openeye Name: ethyl 4-[2-[(4-bromophenyl)sulfonyl-methyl-amino]acetyl]thiomorpholine-3-carboxylate CAS Name: 4-[2-[(4-bromophenyl)sulfonyl-methylamino]-1-oxoethyl]-3-thiomorpholinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-bromophenyl)sulfonyl-methylamino]acetyl]thiomorpholine-3-carboxylate Traditional Name: 4-[2-[brosyl(methyl)amino]acetyl]thiomorpholine-3-carboxylic acid ethyl ester Formula: C16H21BrN2O5S2 MolecularWeight: 465.38234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSCCN1C(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)C1CSCCN1C(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H21BrN2O5S2/c1-3-24-16(21)14-11-25-9-8-19(14)15(20)10-18(2)26(22,23)13-6-4-12(17)5-7-13/h4-7,14H,3,8-11H2,1-2H3