5-(3-chlorophenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(3-chlorophenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(3-chlorophenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]isoxazole-3-carboxamide CAS Name: 5-(3-chlorophenyl)-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-3-isoxazolecarboxamide IUPAC Name: 5-(3-chlorophenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(3-chlorophenyl)-N-[3-[4-(2-pyrimidyl)piperazino]propyl]isoxazole-3-carboxamide Formula: C21H23ClN6O2 MolecularWeight: 426.89932

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=NOC(=C2)C3=CC(=CC=C3)Cl)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=NOC(=C2)C3=CC(=CC=C3)Cl)C4=NC=CC=N4

InChI

InChI=1S/C21H23ClN6O2/c22-17-5-1-4-16(14-17)19-15-18(26-30-19)20(29)23-8-3-9-27-10-12-28(13-11-27)21-24-6-2-7-25-21/h1-2,4-7,14-15H,3,8-13H2,(H,23,29)