1-(4-chlorophenyl)-4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(4-chlorophenyl)-4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(4-chlorophenyl)-4-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]butane-1,4-dione CAS Name: 1-(4-chlorophenyl)-4-[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(4-chlorophenyl)-4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(4-chlorophenyl)-4-[4-(6-piperidinopyrimidin-4-yl)piperazino]butane-1,4-dione Formula: C23H28ClN5O2 MolecularWeight: 441.95372

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)CCC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)CCC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H28ClN5O2/c24-19-6-4-18(5-7-19)20(30)8-9-23(31)29-14-12-28(13-15-29)22-16-21(25-17-26-22)27-10-2-1-3-11-27/h4-7,16-17H,1-3,8-15H2