N-[(1S)-1-(4-butylphenyl)-2-methyl-propyl]-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide

Systemtic Name: N-[(1S)-1-(4-butylphenyl)-2-methyl-propyl]-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide Openeye Name: N-[(1S)-1-(4-butylphenyl)-2-methyl-propyl]-2-(3-methyl-4-oxo-phthalazin-1-yl)acetamide CAS Name: N-[(1S)-1-(4-butylphenyl)-2-methylpropyl]-2-(3-methyl-4-oxo-1-phthalazinyl)acetamide IUPAC Name: N-[(1S)-1-(4-butylphenyl)-2-methylpropyl]-2-(3-methyl-4-oxophthalazin-1-yl)acetamide Traditional Name: N-[(1S)-1-(4-butylphenyl)-2-methyl-propyl]-2-(4-keto-3-methyl-phthalazin-1-yl)acetamide Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(C(C)C)NC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)[C@H](C(C)C)NC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C25H31N3O2/c1-5-6-9-18-12-14-19(15-13-18)24(17(2)3)26-23(29)16-22-20-10-7-8-11-21(20)25(30)28(4)27-22/h7-8,10-15,17,24H,5-6,9,16H2,1-4H3,(H,26,29)/t24-/m0/s1