2-[4-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)carbonylpiperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)carbonylpiperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(5-chloro-1,3-dimethyl-pyrazole-4-carbonyl)piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[(5-chloro-1,3-dimethyl-4-pyrazolyl)-oxomethyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(5-chloro-1,3-dimethylpyrazole-4-carbonyl)piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(5-chloro-1,3-dimethyl-pyrazole-4-carbonyl)piperazino]isonicotinonitrile Formula: C16H17ClN6O MolecularWeight: 344.79878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N)Cl)C

InChI

InChI=1S/C16H17ClN6O/c1-11-14(15(17)21(2)20-11)16(24)23-7-5-22(6-8-23)13-9-12(10-18)3-4-19-13/h3-4,9H,5-8H2,1-2H3