2-(2-imidazol-1-ylethyl)-4-(4-propan-2-ylphenyl)phthalazin-1-one

Systemtic Name: 2-(2-imidazol-1-ylethyl)-4-(4-propan-2-ylphenyl)phthalazin-1-one Openeye Name: 2-(2-imidazol-1-ylethyl)-4-(4-isopropylphenyl)phthalazin-1-one CAS Name: 2-[2-(1-imidazolyl)ethyl]-4-(4-propan-2-ylphenyl)-1-phthalazinone IUPAC Name: 2-(2-imidazol-1-ylethyl)-4-(4-propan-2-ylphenyl)phthalazin-1-one Traditional Name: 2-(2-imidazol-1-ylethyl)-4-p-cumenyl-phthalazin-1-one Formula: C22H22N4O MolecularWeight: 358.43628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCN4C=CN=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCN4C=CN=C4

InChI

InChI=1S/C22H22N4O/c1-16(2)17-7-9-18(10-8-17)21-19-5-3-4-6-20(19)22(27)26(24-21)14-13-25-12-11-23-15-25/h3-12,15-16H,13-14H2,1-2H3