4-[4-(1H-benzimidazol-2-ylmethylamino)phthalazin-1-yl]-N,N-diethyl-benzamide

Systemtic Name: 4-[4-(1H-benzimidazol-2-ylmethylamino)phthalazin-1-yl]-N,N-diethyl-benzamide Openeye Name: 4-[4-(1H-benzimidazol-2-ylmethylamino)phthalazin-1-yl]-N,N-diethyl-benzamide CAS Name: 4-[4-(1H-benzimidazol-2-ylmethylamino)-1-phthalazinyl]-N,N-diethylbenzamide IUPAC Name: 4-[4-(1H-benzimidazol-2-ylmethylamino)phthalazin-1-yl]-N,N-diethylbenzamide Traditional Name: 4-[4-(1H-benzimidazol-2-ylmethylamino)phthalazin-1-yl]-N,N-diethyl-benzamide Formula: C27H26N6O MolecularWeight: 450.53494

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NCC4=NC5=CC=CC=C5N4

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NCC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C27H26N6O/c1-3-33(4-2)27(34)19-15-13-18(14-16-19)25-20-9-5-6-10-21(20)26(32-31-25)28-17-24-29-22-11-7-8-12-23(22)30-24/h5-16H,3-4,17H2,1-2H3,(H,28,32)(H,29,30)