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

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonyl-ethyl]propanamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-(2-thienylsulfonyl)ethyl]-3-(1,3-dioxoisoindolin-2-yl)propanamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonylethyl]-3-(1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonylethyl]-3-(1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-(2-thienylsulfonyl)ethyl]-3-phthalimido-propionamide Formula: C25H25N3O5S2 MolecularWeight: 511.6131

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)CCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNC(=O)CCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C25H25N3O5S2/c1-27(2)18-11-9-17(10-12-18)21(35(32,33)23-8-5-15-34-23)16-26-22(29)13-14-28-24(30)19-6-3-4-7-20(19)25(28)31/h3-12,15,21H,13-14,16H2,1-2H3,(H,26,29)