6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonyl-ethyl]hexanamide

Systemtic Name: 6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonyl-ethyl]hexanamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-(2-thienylsulfonyl)ethyl]-6-(1,3-dioxoisoindolin-2-yl)hexanamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonylethyl]-6-(1,3-dioxo-2-isoindolyl)hexanamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonylethyl]-6-(1,3-dioxoisoindol-2-yl)hexanamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-(2-thienylsulfonyl)ethyl]-6-phthalimido-hexanamide Formula: C28H31N3O5S2 MolecularWeight: 553.69284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C28H31N3O5S2/c1-30(2)21-15-13-20(14-16-21)24(38(35,36)26-12-8-18-37-26)19-29-25(32)11-4-3-7-17-31-27(33)22-9-5-6-10-23(22)28(31)34/h5-6,8-10,12-16,18,24H,3-4,7,11,17,19H2,1-2H3,(H,29,32)