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

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonyl-ethyl]butanamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-(2-thienylsulfonyl)ethyl]-4-(1,3-dioxoisoindolin-2-yl)butanamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonylethyl]-4-(1,3-dioxo-2-isoindolyl)butanamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonylethyl]-4-(1,3-dioxoisoindol-2-yl)butanamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-(2-thienylsulfonyl)ethyl]-4-phthalimido-butyramide Formula: C26H27N3O5S2 MolecularWeight: 525.63968

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C26H27N3O5S2/c1-28(2)19-13-11-18(12-14-19)22(36(33,34)24-10-6-16-35-24)17-27-23(30)9-5-15-29-25(31)20-7-3-4-8-21(20)26(29)32/h3-4,6-8,10-14,16,22H,5,9,15,17H2,1-2H3,(H,27,30)