2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanyl]-6-cyclopropyl-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanyl]-6-cyclopropyl-4-phenyl-pyridine-3-carbonitrile Openeye Name: 6-cyclopropyl-2-[2-(1,3-dioxoisoindolin-2-yl)ethylsulfanyl]-4-phenyl-pyridine-3-carbonitrile CAS Name: 6-cyclopropyl-2-[2-(1,3-dioxo-2-isoindolyl)ethylthio]-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 6-cyclopropyl-2-[2-(1,3-dioxoisoindol-2-yl)ethylsulfanyl]-4-phenylpyridine-3-carbonitrile Traditional Name: 6-cyclopropyl-4-phenyl-2-(2-phthalimidoethylthio)nicotinonitrile Formula: C25H19N3O2S MolecularWeight: 425.50226

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CC1C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H19N3O2S/c26-15-21-20(16-6-2-1-3-7-16)14-22(17-10-11-17)27-23(21)31-13-12-28-24(29)18-8-4-5-9-19(18)25(28)30/h1-9,14,17H,10-13H2