1-[2-(4-chlorophenyl)-3,4-dimethyl-pyrazolo[3,4-d]pyridazin-7-yl]-N-cycloheptyl-piperidine-3-carboxamide

Systemtic Name: 1-[2-(4-chlorophenyl)-3,4-dimethyl-pyrazolo[3,4-d]pyridazin-7-yl]-N-cycloheptyl-piperidine-3-carboxamide Openeye Name: 1-[2-(4-chlorophenyl)-3,4-dimethyl-pyrazolo[3,4-d]pyridazin-7-yl]-N-cycloheptyl-piperidine-3-carboxamide CAS Name: 1-[2-(4-chlorophenyl)-3,4-dimethyl-7-pyrazolo[3,4-d]pyridazinyl]-N-cycloheptyl-3-piperidinecarboxamide IUPAC Name: 1-[2-(4-chlorophenyl)-3,4-dimethylpyrazolo[3,4-d]pyridazin-7-yl]-N-cycloheptylpiperidine-3-carboxamide Traditional Name: 1-[2-(4-chlorophenyl)-3,4-dimethyl-pyrazolo[3,4-d]pyridazin-7-yl]-N-cycloheptyl-nipecotamide Formula: C26H33ClN6O MolecularWeight: 481.03282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN=C(C2=NN1C3=CC=C(C=C3)Cl)N4CCCC(C4)C(=O)NC5CCCCCC5)C

Isomeric SMILES

CC1=C2C(=NN=C(C2=NN1C3=CC=C(C=C3)Cl)N4CCCC(C4)C(=O)NC5CCCCCC5)C

InChI

InChI=1S/C26H33ClN6O/c1-17-23-18(2)33(22-13-11-20(27)12-14-22)31-24(23)25(30-29-17)32-15-7-8-19(16-32)26(34)28-21-9-5-3-4-6-10-21/h11-14,19,21H,3-10,15-16H2,1-2H3,(H,28,34)