2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile Openeye Name: 2-[2-(1,3-dioxoisoindolin-2-yl)ethylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile CAS Name: 2-[2-(1,3-dioxo-2-isoindolyl)ethylthio]-4,5,6-trimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-(1,3-dioxoisoindol-2-yl)ethylsulfanyl]-4,5,6-trimethylpyridine-3-carbonitrile Traditional Name: 4,5,6-trimethyl-2-(2-phthalimidoethylthio)nicotinonitrile Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCCN2C(=O)C3=CC=CC=C3C2=O)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCCN2C(=O)C3=CC=CC=C3C2=O)C

InChI

InChI=1S/C19H17N3O2S/c1-11-12(2)16(10-20)17(21-13(11)3)25-9-8-22-18(23)14-6-4-5-7-15(14)19(22)24/h4-7H,8-9H2,1-3H3