5-chloranyl-N-[2-(4-methyl-2-phenyl-piperazin-1-yl)ethyl]-2-piperidin-1-yl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(4-methyl-2-phenyl-piperazin-1-yl)ethyl]-2-piperidin-1-yl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[2-(4-methyl-2-phenyl-piperazin-1-yl)ethyl]-2-(1-piperidyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[2-(4-methyl-2-phenyl-1-piperazinyl)ethyl]-2-(1-piperidinyl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]-2-piperidin-1-ylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[2-(4-methyl-2-phenyl-piperazino)ethyl]-2-piperidino-pyrimidine-4-carboxamide Formula: C23H31ClN6O MolecularWeight: 442.98484

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(C1)C2=CC=CC=C2)CCNC(=O)C3=NC(=NC=C3Cl)N4CCCCC4

Isomeric SMILES

CN1CCN(C(C1)C2=CC=CC=C2)CCNC(=O)C3=NC(=NC=C3Cl)N4CCCCC4

InChI

InChI=1S/C23H31ClN6O/c1-28-14-15-29(20(17-28)18-8-4-2-5-9-18)13-10-25-22(31)21-19(24)16-26-23(27-21)30-11-6-3-7-12-30/h2,4-5,8-9,16,20H,3,6-7,10-15,17H2,1H3,(H,25,31)