2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(2-cyanoethyl)-N-methyl-ethanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(2-cyanoethyl)-N-methyl-ethanamide Openeye Name: 2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(2-cyanoethyl)-N-methyl-acetamide CAS Name: 2-[(4-bromophenyl)sulfonyl-methylamino]-N-(2-cyanoethyl)-N-methylacetamide IUPAC Name: 2-[(4-bromophenyl)sulfonyl-methylamino]-N-(2-cyanoethyl)-N-methylacetamide Traditional Name: 2-[brosyl(methyl)amino]-N-(2-cyanoethyl)-N-methyl-acetamide Formula: C13H16BrN3O3S MolecularWeight: 374.25344

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CN(C)S(=O)(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CN(CCC#N)C(=O)CN(C)S(=O)(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C13H16BrN3O3S/c1-16(9-3-8-15)13(18)10-17(2)21(19,20)12-6-4-11(14)5-7-12/h4-7H,3,9-10H2,1-2H3