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

Systemtic Name: 6-methyl-2-oxidanylidene-5-[3-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-1H-pyridine-3-carbonitrile Openeye Name: 5-[3-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 5-[3-[2-hydroxy-3-(4-phenyl-1-piperazinyl)propoxy]phenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 5-[3-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 5-[3-[2-hydroxy-3-(4-phenylpiperazino)propoxy]phenyl]-2-keto-6-methyl-1H-pyridine-3-carbonitrile Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=O)N1)C#N)C2=CC(=CC=C2)OCC(CN3CCN(CC3)C4=CC=CC=C4)O

Isomeric SMILES

CC1=C(C=C(C(=O)N1)C#N)C2=CC(=CC=C2)OCC(CN3CCN(CC3)C4=CC=CC=C4)O

InChI

InChI=1S/C26H28N4O3/c1-19-25(15-21(16-27)26(32)28-19)20-6-5-9-24(14-20)33-18-23(31)17-29-10-12-30(13-11-29)22-7-3-2-4-8-22/h2-9,14-15,23,31H,10-13,17-18H2,1H3,(H,28,32)