5-chloranyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-2-(1-pyrrolidinyl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-2-pyrrolidin-1-ylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[3-[4-(2-pyrimidyl)piperazino]propyl]-2-pyrrolidino-pyrimidine-4-carboxamide Formula: C20H27ClN8O MolecularWeight: 430.93438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=C(C(=N2)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4)Cl

Isomeric SMILES

C1CCN(C1)C2=NC=C(C(=N2)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4)Cl

InChI

InChI=1S/C20H27ClN8O/c21-16-15-25-20(28-9-1-2-10-28)26-17(16)18(30)22-7-4-8-27-11-13-29(14-12-27)19-23-5-3-6-24-19/h3,5-6,15H,1-2,4,7-14H2,(H,22,30)