N-[[2-[bis(fluoranyl)methoxy]phenyl]methyl]-5-bromanyl-3-pyrrolidin-1-ylsulfonyl-1H-indole-2-carboxamide

Systemtic Name: N-[[2-[bis(fluoranyl)methoxy]phenyl]methyl]-5-bromanyl-3-pyrrolidin-1-ylsulfonyl-1H-indole-2-carboxamide Openeye Name: 5-bromo-N-[[2-(difluoromethoxy)phenyl]methyl]-3-pyrrolidin-1-ylsulfonyl-1H-indole-2-carboxamide CAS Name: 5-bromo-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(1-pyrrolidinylsulfonyl)-1H-indole-2-carboxamide IUPAC Name: 5-bromo-N-[[2-(difluoromethoxy)phenyl]methyl]-3-pyrrolidin-1-ylsulfonyl-1H-indole-2-carboxamide Traditional Name: 5-bromo-N-[2-(difluoromethoxy)benzyl]-3-pyrrolidinosulfonyl-1H-indole-2-carboxamide Formula: C21H20BrF2N3O4S MolecularWeight: 528.367006

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)C(=O)NCC4=CC=CC=C4OC(F)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)C(=O)NCC4=CC=CC=C4OC(F)F

InChI

InChI=1S/C21H20BrF2N3O4S/c22-14-7-8-16-15(11-14)19(32(29,30)27-9-3-4-10-27)18(26-16)20(28)25-12-13-5-1-2-6-17(13)31-21(23)24/h1-2,5-8,11,21,26H,3-4,9-10,12H2,(H,25,28)