N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide

Systemtic Name: N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Openeye Name: N-[3-(2-oxopyrrolidin-1-yl)phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide CAS Name: N-[3-(2-oxo-1-pyrrolidinyl)phenyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]propanamide IUPAC Name: N-[3-(2-oxopyrrolidin-1-yl)phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Traditional Name: N-[3-(2-ketopyrrolidino)phenyl]-2-[4-(2-pyrimidyl)piperazino]propionamide Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)N2CCCC2=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)N2CCCC2=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H26N6O2/c1-16(25-11-13-26(14-12-25)21-22-8-4-9-23-21)20(29)24-17-5-2-6-18(15-17)27-10-3-7-19(27)28/h2,4-6,8-9,15-16H,3,7,10-14H2,1H3,(H,24,29)