4-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]carbonyl-2-propan-2-yl-phthalazin-1-one

Systemtic Name: 4-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]carbonyl-2-propan-2-yl-phthalazin-1-one Openeye Name: 4-[4-[(3,5-dimethylisoxazol-4-yl)methyl]piperazine-1-carbonyl]-2-isopropyl-phthalazin-1-one CAS Name: 4-[[4-[(3,5-dimethyl-4-isoxazolyl)methyl]-1-piperazinyl]-oxomethyl]-2-propan-2-yl-1-phthalazinone IUPAC Name: 4-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carbonyl]-2-propan-2-ylphthalazin-1-one Traditional Name: 4-[4-[(3,5-dimethylisoxazol-4-yl)methyl]piperazine-1-carbonyl]-2-isopropyl-phthalazin-1-one Formula: C22H27N5O3 MolecularWeight: 409.48148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C

Isomeric SMILES

CC1=C(C(=NO1)C)CN2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C

InChI

InChI=1S/C22H27N5O3/c1-14(2)27-21(28)18-8-6-5-7-17(18)20(23-27)22(29)26-11-9-25(10-12-26)13-19-15(3)24-30-16(19)4/h5-8,14H,9-13H2,1-4H3