1-[4-(3-cyclopropylpropyl)phenyl]-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione

Systemtic Name: 1-[4-(3-cyclopropylpropyl)phenyl]-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione Openeye Name: 1-[4-(3-cyclopropylpropyl)phenyl]-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione CAS Name: 1-[4-(3-cyclopropylpropyl)phenyl]-4-[4-(2-pyrimidinyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-[4-(3-cyclopropylpropyl)phenyl]-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione Traditional Name: 1-[4-(3-cyclopropylpropyl)phenyl]-4-[4-(2-pyrimidyl)piperazino]butane-1,4-dione Formula: C24H30N4O2 MolecularWeight: 406.5206

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CCCC2=CC=C(C=C2)C(=O)CCC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CC1CCCC2=CC=C(C=C2)C(=O)CCC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C24H30N4O2/c29-22(21-9-7-20(8-10-21)4-1-3-19-5-6-19)11-12-23(30)27-15-17-28(18-16-27)24-25-13-2-14-26-24/h2,7-10,13-14,19H,1,3-6,11-12,15-18H2