1-[2-(1-butylpyrazol-4-yl)quinolin-4-yl]carbonylpiperidine-4-carbonitrile

Systemtic Name: 1-[2-(1-butylpyrazol-4-yl)quinolin-4-yl]carbonylpiperidine-4-carbonitrile Openeye Name: 1-[2-(1-butylpyrazol-4-yl)quinoline-4-carbonyl]piperidine-4-carbonitrile CAS Name: 1-[[2-(1-butyl-4-pyrazolyl)-4-quinolinyl]-oxomethyl]-4-piperidinecarbonitrile IUPAC Name: 1-[2-(1-butylpyrazol-4-yl)quinoline-4-carbonyl]piperidine-4-carbonitrile Traditional Name: 1-[2-(1-butylpyrazol-4-yl)quinoline-4-carbonyl]isonipecotonitrile Formula: C23H25N5O MolecularWeight: 387.4775

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCC(CC4)C#N

Isomeric SMILES

CCCCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCC(CC4)C#N

InChI

InChI=1S/C23H25N5O/c1-2-3-10-28-16-18(15-25-28)22-13-20(19-6-4-5-7-21(19)26-22)23(29)27-11-8-17(14-24)9-12-27/h4-7,13,15-17H,2-3,8-12H2,1H3