2-phenyl-1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]butan-1-one

Systemtic Name: 2-phenyl-1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]butan-1-one Openeye Name: 2-phenyl-1-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]butan-1-one CAS Name: 2-phenyl-1-[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]-1-butanone IUPAC Name: 2-phenyl-1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]butan-1-one Traditional Name: 2-phenyl-1-[4-(6-piperidinopyrimidin-4-yl)piperazino]butan-1-one Formula: C23H31N5O MolecularWeight: 393.52514

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4

InChI

InChI=1S/C23H31N5O/c1-2-20(19-9-5-3-6-10-19)23(29)28-15-13-27(14-16-28)22-17-21(24-18-25-22)26-11-7-4-8-12-26/h3,5-6,9-10,17-18,20H,2,4,7-8,11-16H2,1H3