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

Systemtic Name: 4-[[4-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]-5-propan-2-yl-pyrimidin-2-yl]amino]benzamide Openeye Name: 4-[[5-isopropyl-4-[3-(2-oxopyrrolidin-1-yl)propylamino]pyrimidin-2-yl]amino]benzamide CAS Name: 4-[[4-[3-(2-oxo-1-pyrrolidinyl)propylamino]-5-propan-2-yl-2-pyrimidinyl]amino]benzamide IUPAC Name: 4-[[4-[3-(2-oxopyrrolidin-1-yl)propylamino]-5-propan-2-ylpyrimidin-2-yl]amino]benzamide Traditional Name: 4-[[5-isopropyl-4-[3-(2-ketopyrrolidino)propylamino]pyrimidin-2-yl]amino]benzamide Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N6O2/c1-14(2)17-13-24-21(25-16-8-6-15(7-9-16)19(22)29)26-20(17)23-10-4-12-27-11-3-5-18(27)28/h6-9,13-14H,3-5,10-12H2,1-2H3,(H2,22,29)(H2,23,24,25,26)