2-[(2-bromophenyl)-methylsulfonyl-amino]-N-[4-(cyanomethyl)phenyl]ethanamide

Systemtic Name: 2-[(2-bromophenyl)-methylsulfonyl-amino]-N-[4-(cyanomethyl)phenyl]ethanamide Openeye Name: 2-(2-bromo-N-methylsulfonyl-anilino)-N-[4-(cyanomethyl)phenyl]acetamide CAS Name: 2-(2-bromo-N-methylsulfonylanilino)-N-[4-(cyanomethyl)phenyl]acetamide IUPAC Name: 2-(2-bromo-N-methylsulfonylanilino)-N-[4-(cyanomethyl)phenyl]acetamide Traditional Name: 2-(2-bromo-N-mesyl-anilino)-N-[4-(cyanomethyl)phenyl]acetamide Formula: C17H16BrN3O3S MolecularWeight: 422.29624

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)CC#N)C2=CC=CC=C2Br

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)CC#N)C2=CC=CC=C2Br

InChI

InChI=1S/C17H16BrN3O3S/c1-25(23,24)21(16-5-3-2-4-15(16)18)12-17(22)20-14-8-6-13(7-9-14)10-11-19/h2-9H,10,12H2,1H3,(H,20,22)