N-[4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanyl]phenyl]pentanamide

Systemtic Name: N-[4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanyl]phenyl]pentanamide Openeye Name: N-[4-[2-(1,3-dioxoisoindolin-2-yl)ethylsulfanyl]phenyl]pentanamide CAS Name: N-[4-[2-(1,3-dioxo-2-isoindolyl)ethylthio]phenyl]pentanamide IUPAC Name: N-[4-[2-(1,3-dioxoisoindol-2-yl)ethylsulfanyl]phenyl]pentanamide Traditional Name: N-[4-(2-phthalimidoethylthio)phenyl]valeramide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)SCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)SCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H22N2O3S/c1-2-3-8-19(24)22-15-9-11-16(12-10-15)27-14-13-23-20(25)17-6-4-5-7-18(17)21(23)26/h4-7,9-12H,2-3,8,13-14H2,1H3,(H,22,24)