3-[[2,6-bis(fluoranyl)phenyl]methylamino]-N-(pyridin-2-ylmethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 3-[[2,6-bis(fluoranyl)phenyl]methylamino]-N-(pyridin-2-ylmethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 3-[(2,6-difluorophenyl)methylamino]-N-(2-pyridylmethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 3-[(2,6-difluorophenyl)methylamino]-N-(2-pyridinylmethyl)-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 3-[(2,6-difluorophenyl)methylamino]-N-(pyridin-2-ylmethyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 3-[(2,6-difluorobenzyl)amino]-N-(2-pyridylmethyl)-5-pyrrolidinosulfonyl-benzamide Formula: C24H24F2N4O3S MolecularWeight: 486.534166

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)NCC3=C(C=CC=C3F)F)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)NCC3=C(C=CC=C3F)F)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C24H24F2N4O3S/c25-22-7-5-8-23(26)21(22)16-28-19-12-17(24(31)29-15-18-6-1-2-9-27-18)13-20(14-19)34(32,33)30-10-3-4-11-30/h1-2,5-9,12-14,28H,3-4,10-11,15-16H2,(H,29,31)