2-[1-[3-(1-methylsulfonylpiperidin-4-yl)oxyphenyl]-2-oxidanylidene-5-pyridin-2-yl-pyridin-3-yl]benzenecarbonitrile

Systemtic Name: 2-[1-[3-(1-methylsulfonylpiperidin-4-yl)oxyphenyl]-2-oxidanylidene-5-pyridin-2-yl-pyridin-3-yl]benzenecarbonitrile Openeye Name: 2-[1-[3-[(1-methylsulfonyl-4-piperidyl)oxy]phenyl]-2-oxo-5-(2-pyridyl)-3-pyridyl]benzonitrile CAS Name: 2-[1-[3-[(1-methylsulfonyl-4-piperidinyl)oxy]phenyl]-2-oxo-5-(2-pyridinyl)-3-pyridinyl]benzonitrile IUPAC Name: 2-[1-[3-(1-methylsulfonylpiperidin-4-yl)oxyphenyl]-2-oxo-5-pyridin-2-ylpyridin-3-yl]benzonitrile Traditional Name: 2-[2-keto-1-[3-[(1-mesyl-4-piperidyl)oxy]phenyl]-5-(2-pyridyl)-3-pyridyl]benzonitrile Formula: C29H26N4O4S MolecularWeight: 526.60614

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)OC2=CC=CC(=C2)N3C=C(C=C(C3=O)C4=CC=CC=C4C#N)C5=CC=CC=N5

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)OC2=CC=CC(=C2)N3C=C(C=C(C3=O)C4=CC=CC=C4C#N)C5=CC=CC=N5

InChI

InChI=1S/C29H26N4O4S/c1-38(35,36)32-15-12-24(13-16-32)37-25-9-6-8-23(18-25)33-20-22(28-11-4-5-14-31-28)17-27(29(33)34)26-10-3-2-7-21(26)19-30/h2-11,14,17-18,20,24H,12-13,15-16H2,1H3