6-[4-(4-pentan-3-ylpiperazin-1-yl)carbonylpiperidin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-(4-pentan-3-ylpiperazin-1-yl)carbonylpiperidin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-[4-(1-ethylpropyl)piperazine-1-carbonyl]-1-piperidyl]pyridine-3-carbonitrile CAS Name: 6-[4-[oxo-(4-pentan-3-yl-1-piperazinyl)methyl]-1-piperidinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-(4-pentan-3-ylpiperazine-1-carbonyl)piperidin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-[4-(1-ethylpropyl)piperazine-1-carbonyl]piperidino]nicotinonitrile Formula: C21H31N5O MolecularWeight: 369.50374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1CCN(CC1)C(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N

Isomeric SMILES

CCC(CC)N1CCN(CC1)C(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C21H31N5O/c1-3-19(4-2)24-11-13-26(14-12-24)21(27)18-7-9-25(10-8-18)20-6-5-17(15-22)16-23-20/h5-6,16,18-19H,3-4,7-14H2,1-2H3