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

Systemtic Name: 2-[2-oxidanylidene-1-[3-[1-(phenylsulfonyl)piperidin-4-yl]oxyphenyl]-5-pyridin-2-yl-pyridin-3-yl]benzenecarbonitrile Openeye Name: 2-[1-[3-[[1-(benzenesulfonyl)-4-piperidyl]oxy]phenyl]-2-oxo-5-(2-pyridyl)-3-pyridyl]benzonitrile CAS Name: 2-[1-[3-[[1-(benzenesulfonyl)-4-piperidinyl]oxy]phenyl]-2-oxo-5-(2-pyridinyl)-3-pyridinyl]benzonitrile IUPAC Name: 2-[1-[3-[1-(benzenesulfonyl)piperidin-4-yl]oxyphenyl]-2-oxo-5-pyridin-2-ylpyridin-3-yl]benzonitrile Traditional Name: 2-[1-[3-[(1-besyl-4-piperidyl)oxy]phenyl]-2-keto-5-(2-pyridyl)-3-pyridyl]benzonitrile Formula: C34H28N4O4S MolecularWeight: 588.67552

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC=CC(=C2)N3C=C(C=C(C3=O)C4=CC=CC=C4C#N)C5=CC=CC=N5)S(=O)(=O)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1OC2=CC=CC(=C2)N3C=C(C=C(C3=O)C4=CC=CC=C4C#N)C5=CC=CC=N5)S(=O)(=O)C6=CC=CC=C6

InChI

InChI=1S/C34H28N4O4S/c35-23-25-9-4-5-14-31(25)32-21-26(33-15-6-7-18-36-33)24-38(34(32)39)27-10-8-11-29(22-27)42-28-16-19-37(20-17-28)43(40,41)30-12-2-1-3-13-30/h1-15,18,21-22,24,28H,16-17,19-20H2