2-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-(4-isopropylbenzoyl)piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-[oxo-(4-propan-2-ylphenyl)methyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-(4-propan-2-ylbenzoyl)piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-(4-cumoylpiperazino)nicotinonitrile Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=N3)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=N3)C#N

InChI

InChI=1S/C20H22N4O/c1-15(2)16-5-7-17(8-6-16)20(25)24-12-10-23(11-13-24)19-18(14-21)4-3-9-22-19/h3-9,15H,10-13H2,1-2H3