6-[4-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]carbonylpiperidin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]carbonylpiperidin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-[4-[(4-isopropylphenyl)methyl]piperazine-1-carbonyl]-1-piperidyl]pyridine-3-carbonitrile CAS Name: 6-[4-[oxo-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazinyl]methyl]-1-piperidinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-[4-[(4-propan-2-ylphenyl)methyl]piperazine-1-carbonyl]piperidin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-[4-(4-isopropylbenzyl)piperazine-1-carbonyl]piperidino]nicotinonitrile Formula: C26H33N5O MolecularWeight: 431.57312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

InChI

InChI=1S/C26H33N5O/c1-20(2)23-6-3-21(4-7-23)19-29-13-15-31(16-14-29)26(32)24-9-11-30(12-10-24)25-8-5-22(17-27)18-28-25/h3-8,18,20,24H,9-16,19H2,1-2H3