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

Systemtic Name: 6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-methoxyphenyl)-2-thiophen-2-ylsulfonyl-ethyl]hexanamide Openeye Name: 6-(1,3-dioxoisoindolin-2-yl)-N-[2-(4-methoxyphenyl)-2-(2-thienylsulfonyl)ethyl]hexanamide CAS Name: 6-(1,3-dioxo-2-isoindolyl)-N-[2-(4-methoxyphenyl)-2-thiophen-2-ylsulfonylethyl]hexanamide IUPAC Name: 6-(1,3-dioxoisoindol-2-yl)-N-[2-(4-methoxyphenyl)-2-thiophen-2-ylsulfonylethyl]hexanamide Traditional Name: N-[2-(4-methoxyphenyl)-2-(2-thienylsulfonyl)ethyl]-6-phthalimido-hexanamide Formula: C27H28N2O6S2 MolecularWeight: 540.65102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C27H28N2O6S2/c1-35-20-14-12-19(13-15-20)23(37(33,34)25-11-7-17-36-25)18-28-24(30)10-3-2-6-16-29-26(31)21-8-4-5-9-22(21)27(29)32/h4-5,7-9,11-15,17,23H,2-3,6,10,16,18H2,1H3,(H,28,30)