6-(4-chlorophenyl)-2-oxidanylidene-4-(4-pyridin-2-ylpiperazin-1-yl)pyran-3-carbonitrile

Systemtic Name: 6-(4-chlorophenyl)-2-oxidanylidene-4-(4-pyridin-2-ylpiperazin-1-yl)pyran-3-carbonitrile Openeye Name: 6-(4-chlorophenyl)-2-oxo-4-[4-(2-pyridyl)piperazin-1-yl]pyran-3-carbonitrile CAS Name: 6-(4-chlorophenyl)-2-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]-3-pyrancarbonitrile IUPAC Name: 6-(4-chlorophenyl)-2-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)pyran-3-carbonitrile Traditional Name: 6-(4-chlorophenyl)-2-keto-4-[4-(2-pyridyl)piperazino]pyran-3-carbonitrile Formula: C21H17ClN4O2 MolecularWeight: 392.83828

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C3=C(C(=O)OC(=C3)C4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C3=C(C(=O)OC(=C3)C4=CC=C(C=C4)Cl)C#N

InChI

InChI=1S/C21H17ClN4O2/c22-16-6-4-15(5-7-16)19-13-18(17(14-23)21(27)28-19)25-9-11-26(12-10-25)20-3-1-2-8-24-20/h1-8,13H,9-12H2