4-oxidanylidene-3-propan-2-yl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-propan-2-yl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]phthalazine-1-carboxamide Openeye Name: 3-isopropyl-4-oxo-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-propan-2-yl-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-propan-2-yl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]phthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[3-[4-(2-pyrimidyl)piperazino]propyl]phthalazine-1-carboxamide Formula: C23H29N7O2 MolecularWeight: 435.52206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C23H29N7O2/c1-17(2)30-22(32)19-8-4-3-7-18(19)20(27-30)21(31)24-11-6-12-28-13-15-29(16-14-28)23-25-9-5-10-26-23/h3-5,7-10,17H,6,11-16H2,1-2H3,(H,24,31)