(4R)-3-[2-[[3-(pyrimidin-2-ylamino)-1-adamantyl]amino]ethanoyl]-1,3-oxazolidine-4-carbonitrile

Systemtic Name: (4R)-3-[2-[[3-(pyrimidin-2-ylamino)-1-adamantyl]amino]ethanoyl]-1,3-oxazolidine-4-carbonitrile Openeye Name: (4R)-3-[2-[[3-(pyrimidin-2-ylamino)-1-adamantyl]amino]acetyl]oxazolidine-4-carbonitrile CAS Name: (4R)-3-[1-oxo-2-[[3-(2-pyrimidinylamino)-1-adamantyl]amino]ethyl]-4-oxazolidinecarbonitrile IUPAC Name: (4R)-3-[2-[[3-(pyrimidin-2-ylamino)-1-adamantyl]amino]acetyl]-1,3-oxazolidine-4-carbonitrile Traditional Name: (4R)-3-[2-[[3-(2-pyrimidylamino)-1-adamantyl]amino]acetyl]oxazolidine-4-carbonitrile Formula: C20H26N6O2 MolecularWeight: 382.45944

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)NC4=NC=CC=N4)NCC(=O)N5COCC5C#N

Isomeric SMILES

C1[C@H](N(CO1)C(=O)CNC23CC4CC(C2)CC(C4)(C3)NC5=NC=CC=N5)C#N

InChI

InChI=1S/C20H26N6O2/c21-9-16-11-28-13-26(16)17(27)10-24-19-5-14-4-15(6-19)8-20(7-14,12-19)25-18-22-2-1-3-23-18/h1-3,14-16,24H,4-8,10-13H2,(H,22,23,25)/t14?,15?,16-,19?,20?/m1/s1