3-cyclopentyl-1-[4-[4-(4-phenoxyphenyl)pyrimidin-2-yl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-cyclopentyl-1-[4-[4-(4-phenoxyphenyl)pyrimidin-2-yl]piperazin-1-yl]propan-1-one Openeye Name: 3-cyclopentyl-1-[4-[4-(4-phenoxyphenyl)pyrimidin-2-yl]piperazin-1-yl]propan-1-one CAS Name: 3-cyclopentyl-1-[4-[4-(4-phenoxyphenyl)-2-pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-cyclopentyl-1-[4-[4-(4-phenoxyphenyl)pyrimidin-2-yl]piperazin-1-yl]propan-1-one Traditional Name: 3-cyclopentyl-1-[4-[4-(4-phenoxyphenyl)pyrimidin-2-yl]piperazino]propan-1-one Formula: C28H32N4O2 MolecularWeight: 456.57928

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N2CCN(CC2)C3=NC=CC(=N3)C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)CCC(=O)N2CCN(CC2)C3=NC=CC(=N3)C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C28H32N4O2/c33-27(15-10-22-6-4-5-7-22)31-18-20-32(21-19-31)28-29-17-16-26(30-28)23-11-13-25(14-12-23)34-24-8-2-1-3-9-24/h1-3,8-9,11-14,16-17,22H,4-7,10,15,18-21H2