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

Systemtic Name: N-[2-[[2-[2-[[2,4-bis(fluoranyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxidanylidene-ethyl]carbamoyl]cyclohexyl]benzamide Openeye Name: N-[2-[[2-[2-[(2,4-difluorophenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxo-ethyl]carbamoyl]cyclohexyl]benzamide CAS Name: N-[2-[[[2-[2-[(2,4-difluorophenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxoethyl]amino]-oxomethyl]cyclohexyl]benzamide IUPAC Name: N-[2-[[2-[2-[(2,4-difluorophenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxoethyl]carbamoyl]cyclohexyl]benzamide Traditional Name: N-[2-[[2-[2-(2,4-difluorobenzyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-keto-ethyl]carbamoyl]cyclohexyl]benzamide Formula: C29H34F2N4O3 MolecularWeight: 524.602066

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NCC(=O)N2CC3CN(CC3C2)CC4=C(C=C(C=C4)F)F)NC(=O)C5=CC=CC=C5

Isomeric SMILES

C1CCC(C(C1)C(=O)NCC(=O)N2CC3CN(CC3C2)CC4=C(C=C(C=C4)F)F)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H34F2N4O3/c30-23-11-10-20(25(31)12-23)14-34-15-21-17-35(18-22(21)16-34)27(36)13-32-29(38)24-8-4-5-9-26(24)33-28(37)19-6-2-1-3-7-19/h1-3,6-7,10-12,21-22,24,26H,4-5,8-9,13-18H2,(H,32,38)(H,33,37)