pyridin-2-ylmethyl (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-butanoate

Systemtic Name: pyridin-2-ylmethyl (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-butanoate Openeye Name: 2-pyridylmethyl (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-butanoate CAS Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methylbutanoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methylbutanoate Traditional Name: (2S)-2-(brosylamino)-3-methyl-butyric acid 2-pyridylmethyl ester Formula: C17H19BrN2O4S MolecularWeight: 427.31276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=CC=N1)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=CC=CC=N1)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H19BrN2O4S/c1-12(2)16(17(21)24-11-14-5-3-4-10-19-14)20-25(22,23)15-8-6-13(18)7-9-15/h3-10,12,16,20H,11H2,1-2H3/t16-/m0/s1