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

Systemtic Name: N-butan-2-yl-1-[2-(4-chlorophenyl)-3,4-dimethyl-pyrazolo[3,4-d]pyridazin-7-yl]piperidine-3-carboxamide Openeye Name: 1-[2-(4-chlorophenyl)-3,4-dimethyl-pyrazolo[3,4-d]pyridazin-7-yl]-N-sec-butyl-piperidine-3-carboxamide CAS Name: N-butan-2-yl-1-[2-(4-chlorophenyl)-3,4-dimethyl-7-pyrazolo[3,4-d]pyridazinyl]-3-piperidinecarboxamide IUPAC Name: N-butan-2-yl-1-[2-(4-chlorophenyl)-3,4-dimethylpyrazolo[3,4-d]pyridazin-7-yl]piperidine-3-carboxamide Traditional Name: 1-[2-(4-chlorophenyl)-3,4-dimethyl-pyrazolo[3,4-d]pyridazin-7-yl]-N-sec-butyl-nipecotamide Formula: C23H29ClN6O MolecularWeight: 440.96896

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1CCCN(C1)C2=NN=C(C3=C(N(N=C32)C4=CC=C(C=C4)Cl)C)C

Isomeric SMILES

CCC(C)NC(=O)C1CCCN(C1)C2=NN=C(C3=C(N(N=C32)C4=CC=C(C=C4)Cl)C)C

InChI

InChI=1S/C23H29ClN6O/c1-5-14(2)25-23(31)17-7-6-12-29(13-17)22-21-20(15(3)26-27-22)16(4)30(28-21)19-10-8-18(24)9-11-19/h8-11,14,17H,5-7,12-13H2,1-4H3,(H,25,31)