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

Systemtic Name: 1-(3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-7-yl)-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-7-yl)-N-(p-tolylmethyl)piperidine-3-carboxamide CAS Name: 1-(3,4-dimethyl-2-phenyl-7-pyrazolo[3,4-d]pyridazinyl)-N-[(4-methylphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethyl-2-phenylpyrazolo[3,4-d]pyridazin-7-yl)-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-(3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-7-yl)-N-(4-methylbenzyl)nipecotamide Formula: C27H30N6O MolecularWeight: 454.5667

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C3=NN=C(C4=C(N(N=C43)C5=CC=CC=C5)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C3=NN=C(C4=C(N(N=C43)C5=CC=CC=C5)C)C

InChI

InChI=1S/C27H30N6O/c1-18-11-13-21(14-12-18)16-28-27(34)22-8-7-15-32(17-22)26-25-24(19(2)29-30-26)20(3)33(31-25)23-9-5-4-6-10-23/h4-6,9-14,22H,7-8,15-17H2,1-3H3,(H,28,34)