6-methyl-5-[4-[3-[2-(4-methylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 6-methyl-5-[4-[3-[2-(4-methylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 5-[4-[2-hydroxy-3-[2-(p-tolyl)piperazin-1-yl]propoxy]phenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 5-[4-[2-hydroxy-3-[2-(4-methylphenyl)-1-piperazinyl]propoxy]phenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 5-[4-[2-hydroxy-3-[2-(4-methylphenyl)piperazin-1-yl]propoxy]phenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 5-[4-[2-hydroxy-3-[2-(p-tolyl)piperazino]propoxy]phenyl]-2-keto-6-methyl-1H-pyridine-3-carbonitrile Formula: C27H30N4O3 MolecularWeight: 458.5521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CNCCN2CC(COC3=CC=C(C=C3)C4=C(NC(=O)C(=C4)C#N)C)O

Isomeric SMILES

CC1=CC=C(C=C1)C2CNCCN2CC(COC3=CC=C(C=C3)C4=C(NC(=O)C(=C4)C#N)C)O

InChI

InChI=1S/C27H30N4O3/c1-18-3-5-21(6-4-18)26-15-29-11-12-31(26)16-23(32)17-34-24-9-7-20(8-10-24)25-13-22(14-28)27(33)30-19(25)2/h3-10,13,23,26,29,32H,11-12,15-17H2,1-2H3,(H,30,33)