N-[3-[[5-cyclopropyl-4-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]pyrimidin-2-yl]amino]phenyl]ethanamide

Systemtic Name: N-[3-[[5-cyclopropyl-4-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]pyrimidin-2-yl]amino]phenyl]ethanamide Openeye Name: N-[3-[[5-cyclopropyl-4-[3-(2-oxopyrrolidin-1-yl)propylamino]pyrimidin-2-yl]amino]phenyl]acetamide CAS Name: N-[3-[[5-cyclopropyl-4-[3-(2-oxo-1-pyrrolidinyl)propylamino]-2-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: N-[3-[[5-cyclopropyl-4-[3-(2-oxopyrrolidin-1-yl)propylamino]pyrimidin-2-yl]amino]phenyl]acetamide Traditional Name: N-[3-[[5-cyclopropyl-4-[3-(2-ketopyrrolidino)propylamino]pyrimidin-2-yl]amino]phenyl]acetamide Formula: C22H28N6O2 MolecularWeight: 408.49672

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)NC2=NC=C(C(=N2)NCCCN3CCCC3=O)C4CC4

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)NC2=NC=C(C(=N2)NCCCN3CCCC3=O)C4CC4

InChI

InChI=1S/C22H28N6O2/c1-15(29)25-17-5-2-6-18(13-17)26-22-24-14-19(16-8-9-16)21(27-22)23-10-4-12-28-11-3-7-20(28)30/h2,5-6,13-14,16H,3-4,7-12H2,1H3,(H,25,29)(H2,23,24,26,27)