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

Systemtic Name: 1-(3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-7-yl)-N-ethyl-piperidine-3-carboxamide Openeye Name: 1-(3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-7-yl)-N-ethyl-piperidine-3-carboxamide CAS Name: 1-(3,4-dimethyl-2-phenyl-7-pyrazolo[3,4-d]pyridazinyl)-N-ethyl-3-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethyl-2-phenylpyrazolo[3,4-d]pyridazin-7-yl)-N-ethylpiperidine-3-carboxamide Traditional Name: 1-(3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-7-yl)-N-ethyl-nipecotamide Formula: C21H26N6O MolecularWeight: 378.47074

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1CCCN(C1)C2=NN=C(C3=C(N(N=C32)C4=CC=CC=C4)C)C

Isomeric SMILES

CCNC(=O)C1CCCN(C1)C2=NN=C(C3=C(N(N=C32)C4=CC=CC=C4)C)C

InChI

InChI=1S/C21H26N6O/c1-4-22-21(28)16-9-8-12-26(13-16)20-19-18(14(2)23-24-20)15(3)27(25-19)17-10-6-5-7-11-17/h5-7,10-11,16H,4,8-9,12-13H2,1-3H3,(H,22,28)