(3S,3aS,6S,6aR)-N-[1-(cyclopropylamino)-5,5-bis(fluoranyl)-1,2-bis(oxidanylidene)pentan-3-yl]-6-fluoranyl-2-[(2S)-3-methyl-2-[[(2R)-3-methyl-2-(pyrazin-2-ylcarbonylamino)butanoyl]amino]butanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide

Systemtic Name: (3S,3aS,6S,6aR)-N-[1-(cyclopropylamino)-5,5-bis(fluoranyl)-1,2-bis(oxidanylidene)pentan-3-yl]-6-fluoranyl-2-[(2S)-3-methyl-2-[[(2R)-3-methyl-2-(pyrazin-2-ylcarbonylamino)butanoyl]amino]butanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide Openeye Name: (3S,3aS,6S,6aR)-N-[3-(cyclopropylamino)-1-(2,2-difluoroethyl)-2,3-dioxo-propyl]-6-fluoro-2-[(2S)-3-methyl-2-[[(2R)-3-methyl-2-(pyrazine-2-carbonylamino)butanoyl]amino]butanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide CAS Name: (3S,3aS,6S,6aR)-N-[1-(cyclopropylamino)-5,5-difluoro-1,2-dioxopentan-3-yl]-6-fluoro-2-[(2S)-3-methyl-2-[[(2R)-3-methyl-1-oxo-2-[[oxo(2-pyrazinyl)methyl]amino]butyl]amino]-1-oxobutyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide IUPAC Name: (3S,3aS,6S,6aR)-N-[1-(cyclopropylamino)-5,5-difluoro-1,2-dioxopentan-3-yl]-6-fluoro-2-[(2S)-3-methyl-2-[[(2R)-3-methyl-2-(pyrazine-2-carbonylamino)butanoyl]amino]butanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide Traditional Name: (3S,3aS,6S,6aR)-N-[3-(cyclopropylamino)-1-(2,2-difluoroethyl)-2,3-diketo-propyl]-6-fluoro-2-[(2S)-3-methyl-2-[[(2R)-3-methyl-2-(pyrazinoylamino)butanoyl]amino]butanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide Formula: C31H42F3N7O6 MolecularWeight: 665.70369

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C(C)C)C(=O)N1CC2C(C1C(=O)NC(CC(F)F)C(=O)C(=O)NC3CC3)CCC2F)NC(=O)C4=NC=CN=C4

Isomeric SMILES

CC(C)[C@H](C(=O)N[C@@H](C(C)C)C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)NC(CC(F)F)C(=O)C(=O)NC3CC3)CC[C@@H]2F)NC(=O)C4=NC=CN=C4

InChI

InChI=1S/C31H42F3N7O6/c1-14(2)23(39-27(43)21-12-35-9-10-36-21)28(44)40-24(15(3)4)31(47)41-13-18-17(7-8-19(18)32)25(41)29(45)38-20(11-22(33)34)26(42)30(46)37-16-5-6-16/h9-10,12,14-20,22-25H,5-8,11,13H2,1-4H3,(H,37,46)(H,38,45)(H,39,43)(H,40,44)/t17-,18-,19-,20?,23+,24-,25-/m0/s1