4-[[5-(dimethylamino)-4-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]pyrimidin-2-yl]amino]benzamide

Systemtic Name: 4-[[5-(dimethylamino)-4-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]pyrimidin-2-yl]amino]benzamide Openeye Name: 4-[[5-(dimethylamino)-4-[3-(2-oxopyrrolidin-1-yl)propylamino]pyrimidin-2-yl]amino]benzamide CAS Name: 4-[[5-(dimethylamino)-4-[3-(2-oxo-1-pyrrolidinyl)propylamino]-2-pyrimidinyl]amino]benzamide IUPAC Name: 4-[[5-(dimethylamino)-4-[3-(2-oxopyrrolidin-1-yl)propylamino]pyrimidin-2-yl]amino]benzamide Traditional Name: 4-[[5-(dimethylamino)-4-[3-(2-ketopyrrolidino)propylamino]pyrimidin-2-yl]amino]benzamide Formula: C20H27N7O2 MolecularWeight: 397.47408

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CN=C(N=C1NCCCN2CCCC2=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CN(C)C1=CN=C(N=C1NCCCN2CCCC2=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C20H27N7O2/c1-26(2)16-13-23-20(24-15-8-6-14(7-9-15)18(21)29)25-19(16)22-10-4-12-27-11-3-5-17(27)28/h6-9,13H,3-5,10-12H2,1-2H3,(H2,21,29)(H2,22,23,24,25)