N-[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(2-methyl-1,3-dioxo-isoindolin-5-yl)-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(2-methyl-1,3-dioxo-5-isoindolyl)-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(1,3-diketo-2-methyl-isoindolin-5-yl)-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C20H18N4O6S MolecularWeight: 442.44512

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4

InChI

InChI=1S/C20H18N4O6S/c1-23-19(27)15-6-5-13(10-16(15)20(23)28)22-18(26)12-3-2-4-14(9-12)31(29,30)24-8-7-21-17(25)11-24/h2-6,9-10H,7-8,11H2,1H3,(H,21,25)(H,22,26)