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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=C(C=C3)C4=C(NC(=O)C(=C4)C#N)C)O

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=C(C=C3)C4=C(NC(=O)C(=C4)C#N)C)O

InChI

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