2-[4-[3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]propanoyl]piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]propanoyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-[3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)propanoyl]piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[3-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]-1-oxopropyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-[3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]propanoyl]piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-[3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)propanoyl]piperazino]isonicotinonitrile Formula: C22H30N6O MolecularWeight: 394.5132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C)C)CCC(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N

Isomeric SMILES

CC1=C(C(=NN1CC(C)C)C)CCC(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N

InChI

InChI=1S/C22H30N6O/c1-16(2)15-28-18(4)20(17(3)25-28)5-6-22(29)27-11-9-26(10-12-27)21-13-19(14-23)7-8-24-21/h7-8,13,16H,5-6,9-12,15H2,1-4H3