2-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-phenyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-phenyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-2-phenyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-2-phenyl-N-[6-(1-pyrrolidinylsulfonyl)-1,3-benzothiazol-2-yl]acetamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-2-phenyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-phenyl-2-phthalimido-N-(6-pyrrolidinosulfonyl-1,3-benzothiazol-2-yl)acetamide Formula: C27H22N4O5S2 MolecularWeight: 546.61738

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C(C4=CC=CC=C4)N5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C(C4=CC=CC=C4)N5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C27H22N4O5S2/c32-24(23(17-8-2-1-3-9-17)31-25(33)19-10-4-5-11-20(19)26(31)34)29-27-28-21-13-12-18(16-22(21)37-27)38(35,36)30-14-6-7-15-30/h1-5,8-13,16,23H,6-7,14-15H2,(H,28,29,32)