4-[4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-[(1,3-dioxoisoindolin-2-yl)methyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[(1,3-dioxo-2-isoindolyl)methyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-[(1,3-dioxoisoindol-2-yl)methyl]piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-[4-(phthalimidomethyl)piperazino]sulfonyl-pyrrole-2-carboxamide Formula: C19H21N5O5S MolecularWeight: 431.46554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H21N5O5S/c1-21-11-13(10-16(21)17(20)25)30(28,29)23-8-6-22(7-9-23)12-24-18(26)14-4-2-3-5-15(14)19(24)27/h2-5,10-11H,6-9,12H2,1H3,(H2,20,25)