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

Systemtic Name: 4-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propylsulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[3-(1,3-dioxoisoindolin-2-yl)propylsulfanylmethyl]benzonitrile CAS Name: 4-[[3-(1,3-dioxo-2-isoindolyl)propylthio]methyl]benzonitrile IUPAC Name: 4-[3-(1,3-dioxoisoindol-2-yl)propylsulfanylmethyl]benzonitrile Traditional Name: 4-[(3-phthalimidopropylthio)methyl]benzonitrile Formula: C19H16N2O2S MolecularWeight: 336.40754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCSCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCSCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H16N2O2S/c20-12-14-6-8-15(9-7-14)13-24-11-3-10-21-18(22)16-4-1-2-5-17(16)19(21)23/h1-2,4-9H,3,10-11,13H2