phenyl-[2-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]carbonylphenyl]methanone

Systemtic Name: phenyl-[2-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]carbonylphenyl]methanone Openeye Name: phenyl-[2-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazine-1-carbonyl]phenyl]methanone CAS Name: [2-[oxo-[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]methyl]phenyl]-phenylmethanone IUPAC Name: phenyl-[2-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazine-1-carbonyl]phenyl]methanone Traditional Name: phenyl-[2-[4-(6-piperidinopyrimidin-4-yl)piperazine-1-carbonyl]phenyl]methanone Formula: C27H29N5O2 MolecularWeight: 455.55146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC=CC=C4C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC=CC=C4C(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H29N5O2/c33-26(21-9-3-1-4-10-21)22-11-5-6-12-23(22)27(34)32-17-15-31(16-18-32)25-19-24(28-20-29-25)30-13-7-2-8-14-30/h1,3-6,9-12,19-20H,2,7-8,13-18H2