N-(2,6-dimethylphenyl)-2-[4-(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylpiperazin-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-(3-isopropyl-4-oxo-phthalazine-1-carbonyl)piperazin-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[oxo-(4-oxo-3-propan-2-yl-1-phthalazinyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(4-oxo-3-propan-2-ylphthalazine-1-carbonyl)piperazin-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-(3-isopropyl-4-keto-phthalazine-1-carbonyl)piperazino]acetamide Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C

InChI

InChI=1S/C26H31N5O3/c1-17(2)31-25(33)21-11-6-5-10-20(21)24(28-31)26(34)30-14-12-29(13-15-30)16-22(32)27-23-18(3)8-7-9-19(23)4/h5-11,17H,12-16H2,1-4H3,(H,27,32)