2-[(3-bromophenyl)-methylsulfonyl-amino]-N-butan-2-yl-ethanamide

Systemtic Name: 2-[(3-bromophenyl)-methylsulfonyl-amino]-N-butan-2-yl-ethanamide Openeye Name: 2-(3-bromo-N-methylsulfonyl-anilino)-N-sec-butyl-acetamide CAS Name: 2-(3-bromo-N-methylsulfonylanilino)-N-butan-2-ylacetamide IUPAC Name: 2-(3-bromo-N-methylsulfonylanilino)-N-butan-2-ylacetamide Traditional Name: 2-(3-bromo-N-mesyl-anilino)-N-sec-butyl-acetamide Formula: C13H19BrN2O3S MolecularWeight: 363.27056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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