3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)-N-[6-(1-piperidylsulfonyl)-1,3-benzothiazol-2-yl]benzamide CAS Name: 3-(1,3-dioxo-2-isoindolyl)-N-[6-(1-piperidinylsulfonyl)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 3-phthalimido-N-(6-piperidinosulfonyl-1,3-benzothiazol-2-yl)benzamide Formula: C27H22N4O5S2 MolecularWeight: 546.61738

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC(=CC=C4)N5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC(=CC=C4)N5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C27H22N4O5S2/c32-24(17-7-6-8-18(15-17)31-25(33)20-9-2-3-10-21(20)26(31)34)29-27-28-22-12-11-19(16-23(22)37-27)38(35,36)30-13-4-1-5-14-30/h2-3,6-12,15-16H,1,4-5,13-14H2,(H,28,29,32)