2-[(4-bromophenyl)-methylsulfonyl-amino]-N-[(2S)-butan-2-yl]ethanamide

Systemtic Name: 2-[(4-bromophenyl)-methylsulfonyl-amino]-N-[(2S)-butan-2-yl]ethanamide Openeye Name: 2-(4-bromo-N-methylsulfonyl-anilino)-N-[(1S)-1-methylpropyl]acetamide CAS Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[(2S)-butan-2-yl]acetamide IUPAC Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[(2S)-butan-2-yl]acetamide Traditional Name: 2-(4-bromo-N-mesyl-anilino)-N-[(1S)-1-methylpropyl]acetamide Formula: C13H19BrN2O3S MolecularWeight: 363.27056

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CN(C1=CC=C(C=C1)Br)S(=O)(=O)C

Isomeric SMILES

CC[C@H](C)NC(=O)CN(C1=CC=C(C=C1)Br)S(=O)(=O)C

InChI

InChI=1S/C13H19BrN2O3S/c1-4-10(2)15-13(17)9-16(20(3,18)19)12-7-5-11(14)6-8-12/h5-8,10H,4,9H2,1-3H3,(H,15,17)/t10-/m0/s1