2-bromanyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-[(3-fluoro-4-methoxy-phenyl)methyl]-N-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-(3-fluoro-4-methoxy-benzyl)-N-methyl-5-pyrrolidinosulfonyl-benzamide Formula: C20H22BrFN2O4S MolecularWeight: 485.367083

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Br

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Br

InChI

InChI=1S/C20H22BrFN2O4S/c1-23(13-14-5-8-19(28-2)18(22)11-14)20(25)16-12-15(6-7-17(16)21)29(26,27)24-9-3-4-10-24/h5-8,11-12H,3-4,9-10,13H2,1-2H3