(3R,4R)-2,2-bis(fluoranyl)-N,6-dimethyl-4-[[(2S)-3-methyl-1-[[(2S)-3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]-1-oxidanylidene-butan-2-yl]amino]-3-oxidanyl-heptanamide

Systemtic Name: (3R,4R)-2,2-bis(fluoranyl)-N,6-dimethyl-4-[[(2S)-3-methyl-1-[[(2S)-3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]-1-oxidanylidene-butan-2-yl]amino]-3-oxidanyl-heptanamide Openeye Name: (3R,4R)-2,2-difluoro-3-hydroxy-N,6-dimethyl-4-[[(1S)-2-methyl-1-[[(2S)-3-methyl-2-(3-methylbutanoylamino)butanoyl]carbamoyl]propyl]amino]heptanamide CAS Name: (3R,4R)-2,2-difluoro-3-hydroxy-N,6-dimethyl-4-[[(2S)-3-methyl-1-[[(2S)-3-methyl-2-[(3-methyl-1-oxobutyl)amino]-1-oxobutyl]amino]-1-oxobutan-2-yl]amino]heptanamide IUPAC Name: (3R,4R)-2,2-difluoro-3-hydroxy-N,6-dimethyl-4-[[(2S)-3-methyl-1-[[(2S)-3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]-1-oxobutan-2-yl]amino]heptanamide Traditional Name: (3R,4R)-2,2-difluoro-3-hydroxy-4-[[(1S)-1-[[(2S)-2-(isovalerylamino)-3-methyl-butanoyl]carbamoyl]-2-methyl-propyl]amino]-N,6-dimethyl-enanthamide Formula: C24H44F2N4O5 MolecularWeight: 506.626766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C(C(=O)NC)(F)F)O)NC(C(C)C)C(=O)NC(=O)C(C(C)C)NC(=O)CC(C)C

Isomeric SMILES

CC(C)C[C@H]([C@H](C(C(=O)NC)(F)F)O)N[C@@H](C(C)C)C(=O)NC(=O)[C@H](C(C)C)NC(=O)CC(C)C

InChI

InChI=1S/C24H44F2N4O5/c1-12(2)10-16(20(32)24(25,26)23(35)27-9)28-18(14(5)6)21(33)30-22(34)19(15(7)8)29-17(31)11-13(3)4/h12-16,18-20,28,32H,10-11H2,1-9H3,(H,27,35)(H,29,31)(H,30,33,34)/t16-,18+,19+,20-/m1/s1