4-(4-cyclopropylcarbonylpiperazin-1-yl)carbonyl-2-(2-methylpropyl)phthalazin-1-one

Systemtic Name: 4-(4-cyclopropylcarbonylpiperazin-1-yl)carbonyl-2-(2-methylpropyl)phthalazin-1-one Openeye Name: 4-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-2-isobutyl-phthalazin-1-one CAS Name: 4-[[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-2-(2-methylpropyl)-1-phthalazinone IUPAC Name: 4-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-2-(2-methylpropyl)phthalazin-1-one Traditional Name: 4-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-2-isobutyl-phthalazin-1-one Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C21H26N4O3/c1-14(2)13-25-20(27)17-6-4-3-5-16(17)18(22-25)21(28)24-11-9-23(10-12-24)19(26)15-7-8-15/h3-6,14-15H,7-13H2,1-2H3