4-methyl-2-[2-[4-(3-methylbutanoyl)piperazin-1-yl]-2-oxidanylidene-ethyl]phthalazin-1-one

Systemtic Name: 4-methyl-2-[2-[4-(3-methylbutanoyl)piperazin-1-yl]-2-oxidanylidene-ethyl]phthalazin-1-one Openeye Name: 4-methyl-2-[2-[4-(3-methylbutanoyl)piperazin-1-yl]-2-oxo-ethyl]phthalazin-1-one CAS Name: 4-methyl-2-[2-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]-2-oxoethyl]-1-phthalazinone IUPAC Name: 4-methyl-2-[2-[4-(3-methylbutanoyl)piperazin-1-yl]-2-oxoethyl]phthalazin-1-one Traditional Name: 2-[2-(4-isovalerylpiperazino)-2-keto-ethyl]-4-methyl-phthalazin-1-one Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)N3CCN(CC3)C(=O)CC(C)C

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)N3CCN(CC3)C(=O)CC(C)C

InChI

InChI=1S/C20H26N4O3/c1-14(2)12-18(25)22-8-10-23(11-9-22)19(26)13-24-20(27)17-7-5-4-6-16(17)15(3)21-24/h4-7,14H,8-13H2,1-3H3