2-[2-(1,5-dimethyl-3-pyridazin-3-yl-pyrazol-4-yl)ethyl]-N-quinolin-3-yl-benzamide

Systemtic Name: 2-[2-(1,5-dimethyl-3-pyridazin-3-yl-pyrazol-4-yl)ethyl]-N-quinolin-3-yl-benzamide Openeye Name: 2-[2-(1,5-dimethyl-3-pyridazin-3-yl-pyrazol-4-yl)ethyl]-N-(3-quinolyl)benzamide CAS Name: 2-[2-[1,5-dimethyl-3-(3-pyridazinyl)-4-pyrazolyl]ethyl]-N-(3-quinolinyl)benzamide IUPAC Name: 2-[2-(1,5-dimethyl-3-pyridazin-3-ylpyrazol-4-yl)ethyl]-N-quinolin-3-ylbenzamide Traditional Name: 2-[2-(1,5-dimethyl-3-pyridazin-3-yl-pyrazol-4-yl)ethyl]-N-(3-quinolyl)benzamide Formula: C27H24N6O MolecularWeight: 448.51906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C2=NN=CC=C2)CCC3=CC=CC=C3C(=O)NC4=CC5=CC=CC=C5N=C4

Isomeric SMILES

CC1=C(C(=NN1C)C2=NN=CC=C2)CCC3=CC=CC=C3C(=O)NC4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C27H24N6O/c1-18-22(26(32-33(18)2)25-12-7-15-29-31-25)14-13-19-8-3-5-10-23(19)27(34)30-21-16-20-9-4-6-11-24(20)28-17-21/h3-12,15-17H,13-14H2,1-2H3,(H,30,34)