N-(3-chloranyl-2-methyl-phenyl)-1-(3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-7-yl)piperidine-3-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-1-(3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-7-yl)piperidine-3-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-1-(3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-7-yl)piperidine-3-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-1-(3,4-dimethyl-2-phenyl-7-pyrazolo[3,4-d]pyridazinyl)-3-piperidinecarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-1-(3,4-dimethyl-2-phenylpyrazolo[3,4-d]pyridazin-7-yl)piperidine-3-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-1-(3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-7-yl)nipecotamide Formula: C26H27ClN6O MolecularWeight: 474.98518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2CCCN(C2)C3=NN=C(C4=C(N(N=C43)C5=CC=CC=C5)C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2CCCN(C2)C3=NN=C(C4=C(N(N=C43)C5=CC=CC=C5)C)C

InChI

InChI=1S/C26H27ClN6O/c1-16-21(27)12-7-13-22(16)28-26(34)19-9-8-14-32(15-19)25-24-23(17(2)29-30-25)18(3)33(31-24)20-10-5-4-6-11-20/h4-7,10-13,19H,8-9,14-15H2,1-3H3,(H,28,34)