2-[(4-bromophenyl)-methylsulfonyl-amino]-N-(2-pyrrolidin-1-ylcarbonylphenyl)ethanamide

Systemtic Name: 2-[(4-bromophenyl)-methylsulfonyl-amino]-N-(2-pyrrolidin-1-ylcarbonylphenyl)ethanamide Openeye Name: 2-(4-bromo-N-methylsulfonyl-anilino)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide CAS Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[2-[oxo(1-pyrrolidinyl)methyl]phenyl]acetamide IUPAC Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide Traditional Name: 2-(4-bromo-N-mesyl-anilino)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)N2CCCC2)C3=CC=C(C=C3)Br

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)N2CCCC2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrN3O4S/c1-29(27,28)24(16-10-8-15(21)9-11-16)14-19(25)22-18-7-3-2-6-17(18)20(26)23-12-4-5-13-23/h2-3,6-11H,4-5,12-14H2,1H3,(H,22,25)