(2R)-N-(1-adamantylcarbamoyl)-2-[[(1R)-1-[2,4-bis(fluoranyl)phenyl]ethyl]amino]propanamide

Systemtic Name: (2R)-N-(1-adamantylcarbamoyl)-2-[[(1R)-1-[2,4-bis(fluoranyl)phenyl]ethyl]amino]propanamide Openeye Name: (2R)-N-(1-adamantylcarbamoyl)-2-[[(1R)-1-(2,4-difluorophenyl)ethyl]amino]propanamide CAS Name: (2R)-N-[(1-adamantylamino)-oxomethyl]-2-[[(1R)-1-(2,4-difluorophenyl)ethyl]amino]propanamide IUPAC Name: (2R)-N-(1-adamantylcarbamoyl)-2-[[(1R)-1-(2,4-difluorophenyl)ethyl]amino]propanamide Traditional Name: (2R)-N-(1-adamantylcarbamoyl)-2-[[(1R)-1-(2,4-difluorophenyl)ethyl]amino]propionamide Formula: C22H29F2N3O2 MolecularWeight: 405.481366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)F)F)NC(C)C(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[C@H](C1=C(C=C(C=C1)F)F)N[C@H](C)C(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H29F2N3O2/c1-12(18-4-3-17(23)8-19(18)24)25-13(2)20(28)26-21(29)27-22-9-14-5-15(10-22)7-16(6-14)11-22/h3-4,8,12-16,25H,5-7,9-11H2,1-2H3,(H2,26,27,28,29)/t12-,13-,14?,15?,16?,22?/m1/s1