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

Systemtic Name: 4-[2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propylsulfanyl]ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[3-(1,3-dioxoisoindolin-2-yl)propylsulfanyl]ethoxy]benzonitrile CAS Name: 4-[2-[3-(1,3-dioxo-2-isoindolyl)propylthio]ethoxy]benzonitrile IUPAC Name: 4-[2-[3-(1,3-dioxoisoindol-2-yl)propylsulfanyl]ethoxy]benzonitrile Traditional Name: 4-[2-(3-phthalimidopropylthio)ethoxy]benzonitrile Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCSCCOC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCSCCOC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H18N2O3S/c21-14-15-6-8-16(9-7-15)25-11-13-26-12-3-10-22-19(23)17-4-1-2-5-18(17)20(22)24/h1-2,4-9H,3,10-13H2