1-[3-[[4-(pyridin-4-ylmethyl)phthalazin-1-yl]amino]phenyl]ethanone

Systemtic Name: 1-[3-[[4-(pyridin-4-ylmethyl)phthalazin-1-yl]amino]phenyl]ethanone Openeye Name: 1-[3-[[4-(4-pyridylmethyl)phthalazin-1-yl]amino]phenyl]ethanone CAS Name: 1-[3-[[4-(pyridin-4-ylmethyl)-1-phthalazinyl]amino]phenyl]ethanone IUPAC Name: 1-[3-[[4-(pyridin-4-ylmethyl)phthalazin-1-yl]amino]phenyl]ethanone Traditional Name: 1-[3-[[4-(4-pyridylmethyl)phthalazin-1-yl]amino]phenyl]ethanone Formula: C22H18N4O MolecularWeight: 354.40452

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC2=NN=C(C3=CC=CC=C32)CC4=CC=NC=C4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC2=NN=C(C3=CC=CC=C32)CC4=CC=NC=C4

InChI

InChI=1S/C22H18N4O/c1-15(27)17-5-4-6-18(14-17)24-22-20-8-3-2-7-19(20)21(25-26-22)13-16-9-11-23-12-10-16/h2-12,14H,13H2,1H3,(H,24,26)