4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[2-(1,3-dioxoisoindolin-2-yl)ethylsulfanylmethyl]benzonitrile CAS Name: 4-[[2-(1,3-dioxo-2-isoindolyl)ethylthio]methyl]benzonitrile IUPAC Name: 4-[2-(1,3-dioxoisoindol-2-yl)ethylsulfanylmethyl]benzonitrile Traditional Name: 4-[(2-phthalimidoethylthio)methyl]benzonitrile Formula: C18H14N2O2S MolecularWeight: 322.38096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H14N2O2S/c19-11-13-5-7-14(8-6-13)12-23-10-9-20-17(21)15-3-1-2-4-16(15)18(20)22/h1-8H,9-10,12H2