2-bromanyl-N-[[4-(dimethylcarbamoyl)phenyl]methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-[[4-(dimethylcarbamoyl)phenyl]methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-[[4-(dimethylcarbamoyl)phenyl]methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-[[4-[dimethylamino(oxo)methyl]phenyl]methyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-[[4-(dimethylcarbamoyl)phenyl]methyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-[4-(dimethylcarbamoyl)benzyl]-5-pyrrolidinosulfonyl-benzamide Formula: C21H24BrN3O4S MolecularWeight: 494.40196

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Br

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Br

InChI

InChI=1S/C21H24BrN3O4S/c1-24(2)21(27)16-7-5-15(6-8-16)14-23-20(26)18-13-17(9-10-19(18)22)30(28,29)25-11-3-4-12-25/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,23,26)