4-[4-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]carbonyl-2-propyl-phthalazin-1-one

Systemtic Name: 4-[4-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]carbonyl-2-propyl-phthalazin-1-one Openeye Name: 4-[4-[2-(2-methyl-1-piperidyl)-2-oxo-ethyl]piperazine-1-carbonyl]-2-propyl-phthalazin-1-one CAS Name: 4-[[4-[2-(2-methyl-1-piperidinyl)-2-oxoethyl]-1-piperazinyl]-oxomethyl]-2-propyl-1-phthalazinone IUPAC Name: 4-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazine-1-carbonyl]-2-propylphthalazin-1-one Traditional Name: 4-[4-[2-keto-2-(2-methylpiperidino)ethyl]piperazine-1-carbonyl]-2-propyl-phthalazin-1-one Formula: C24H33N5O3 MolecularWeight: 439.55052

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CC(=O)N4CCCCC4C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CC(=O)N4CCCCC4C

InChI

InChI=1S/C24H33N5O3/c1-3-11-29-23(31)20-10-5-4-9-19(20)22(25-29)24(32)27-15-13-26(14-16-27)17-21(30)28-12-7-6-8-18(28)2/h4-5,9-10,18H,3,6-8,11-17H2,1-2H3