2-azanyl-N-[2-[2-[[2,4-bis(fluoranyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxidanylidene-ethyl]-5-iodanyl-benzamide

Systemtic Name: 2-azanyl-N-[2-[2-[[2,4-bis(fluoranyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxidanylidene-ethyl]-5-iodanyl-benzamide Openeye Name: 2-amino-N-[2-[2-[(2,4-difluorophenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxo-ethyl]-5-iodo-benzamide CAS Name: 2-amino-N-[2-[2-[(2,4-difluorophenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxoethyl]-5-iodobenzamide IUPAC Name: 2-amino-N-[2-[2-[(2,4-difluorophenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxoethyl]-5-iodobenzamide Traditional Name: 2-amino-N-[2-[2-(2,4-difluorobenzyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-keto-ethyl]-5-iodo-benzamide Formula: C22H23F2IN4O2 MolecularWeight: 540.344896

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CN(CC2CN1CC3=C(C=C(C=C3)F)F)C(=O)CNC(=O)C4=C(C=CC(=C4)I)N

Isomeric SMILES

C1C2CN(CC2CN1CC3=C(C=C(C=C3)F)F)C(=O)CNC(=O)C4=C(C=CC(=C4)I)N

InChI

InChI=1S/C22H23F2IN4O2/c23-16-2-1-13(19(24)5-16)8-28-9-14-11-29(12-15(14)10-28)21(30)7-27-22(31)18-6-17(25)3-4-20(18)26/h1-6,14-15H,7-12,26H2,(H,27,31)