2-[2-[2-(2-oxidanylsulfonothioyloxyethylamino)ethylsulfanyl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[2-(2-oxidanylsulfonothioyloxyethylamino)ethylsulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[2-(2-hydroxysulfonothioyloxyethylamino)ethylsulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[2-(2-hydroxysulfonothioyloxyethylamino)ethylthio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[2-(2-hydroxysulfonothioyloxyethylamino)ethylsulfanyl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[2-(2-hydroxysulfonothioyloxyethylamino)ethylthio]ethyl]isoindoline-1,3-quinone Formula: C14H18N2O5S3 MolecularWeight: 390.49812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSCCNCCOS(=O)(=S)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSCCNCCOS(=O)(=S)O

InChI

InChI=1S/C14H18N2O5S3/c17-13-11-3-1-2-4-12(11)14(18)16(13)7-10-23-9-6-15-5-8-21-24(19,20)22/h1-4,15H,5-10H2,(H,19,20,22)