5-(5-bromanyl-2-oxidanyl-phenyl)carbonyl-2-oxidanylidene-1-(3-piperidin-1-ylsulfonylphenyl)pyridine-3-carbonitrile

Systemtic Name: 5-(5-bromanyl-2-oxidanyl-phenyl)carbonyl-2-oxidanylidene-1-(3-piperidin-1-ylsulfonylphenyl)pyridine-3-carbonitrile Openeye Name: 5-(5-bromo-2-hydroxy-benzoyl)-2-oxo-1-[3-(1-piperidylsulfonyl)phenyl]pyridine-3-carbonitrile CAS Name: 5-[(5-bromo-2-hydroxyphenyl)-oxomethyl]-2-oxo-1-[3-(1-piperidinylsulfonyl)phenyl]-3-pyridinecarbonitrile IUPAC Name: 5-(5-bromo-2-hydroxybenzoyl)-2-oxo-1-(3-piperidin-1-ylsulfonylphenyl)pyridine-3-carbonitrile Traditional Name: 5-(5-bromo-2-hydroxy-benzoyl)-2-keto-1-(3-piperidinosulfonylphenyl)nicotinonitrile Formula: C24H20BrN3O5S MolecularWeight: 542.4017

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)N3C=C(C=C(C3=O)C#N)C(=O)C4=C(C=CC(=C4)Br)O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)N3C=C(C=C(C3=O)C#N)C(=O)C4=C(C=CC(=C4)Br)O

InChI

InChI=1S/C24H20BrN3O5S/c25-18-7-8-22(29)21(12-18)23(30)17-11-16(14-26)24(31)28(15-17)19-5-4-6-20(13-19)34(32,33)27-9-2-1-3-10-27/h4-8,11-13,15,29H,1-3,9-10H2