2-chloranyl-N-[2-(3-piperidin-1-ylsulfonylphenyl)-3H-isoindol-1-ylidene]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[2-(3-piperidin-1-ylsulfonylphenyl)-3H-isoindol-1-ylidene]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[2-[3-(1-piperidylsulfonyl)phenyl]isoindolin-1-ylidene]pyridine-3-carboxamide CAS Name: 2-chloro-N-[2-[3-(1-piperidinylsulfonyl)phenyl]-3H-isoindol-1-ylidene]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[2-(3-piperidin-1-ylsulfonylphenyl)-3H-isoindol-1-ylidene]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[2-(3-piperidinosulfonylphenyl)isoindolin-1-ylidene]nicotinamide Formula: C25H23ClN4O3S MolecularWeight: 494.99312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)N3CC4=CC=CC=C4C3=NC(=O)C5=C(N=CC=C5)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)N3CC4=CC=CC=C4C3=NC(=O)C5=C(N=CC=C5)Cl

InChI

InChI=1S/C25H23ClN4O3S/c26-23-22(12-7-13-27-23)25(31)28-24-21-11-3-2-8-18(21)17-30(24)19-9-6-10-20(16-19)34(32,33)29-14-4-1-5-15-29/h2-3,6-13,16H,1,4-5,14-15,17H2