4-[4-(2-dimethylaminoethyl)piperazin-1-yl]carbonyl-2-(2-methylpropyl)phthalazin-1-one

Systemtic Name: 4-[4-(2-dimethylaminoethyl)piperazin-1-yl]carbonyl-2-(2-methylpropyl)phthalazin-1-one Openeye Name: 4-[4-(2-dimethylaminoethyl)piperazine-1-carbonyl]-2-isobutyl-phthalazin-1-one CAS Name: 4-[[4-(2-dimethylaminoethyl)-1-piperazinyl]-oxomethyl]-2-(2-methylpropyl)-1-phthalazinone IUPAC Name: 4-[4-(2-dimethylaminoethyl)piperazine-1-carbonyl]-2-(2-methylpropyl)phthalazin-1-one Traditional Name: 4-[4-(2-dimethylaminoethyl)piperazine-1-carbonyl]-2-isobutyl-phthalazin-1-one Formula: C21H31N5O2 MolecularWeight: 385.50314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31N5O2/c1-16(2)15-26-20(27)18-8-6-5-7-17(18)19(22-26)21(28)25-13-11-24(12-14-25)10-9-23(3)4/h5-8,16H,9-15H2,1-4H3