2-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butylsulfanyl]-N-cyclooctyl-ethanamide

Systemtic Name: 2-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butylsulfanyl]-N-cyclooctyl-ethanamide Openeye Name: N-cyclooctyl-2-[4-(1,3-dioxoisoindolin-2-yl)butylsulfanyl]acetamide CAS Name: N-cyclooctyl-2-[4-(1,3-dioxo-2-isoindolyl)butylthio]acetamide IUPAC Name: N-cyclooctyl-2-[4-(1,3-dioxoisoindol-2-yl)butylsulfanyl]acetamide Traditional Name: N-cyclooctyl-2-(4-phthalimidobutylthio)acetamide Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C22H30N2O3S/c25-20(23-17-10-4-2-1-3-5-11-17)16-28-15-9-8-14-24-21(26)18-12-6-7-13-19(18)22(24)27/h6-7,12-13,17H,1-5,8-11,14-16H2,(H,23,25)