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

Systemtic Name: 1-methyl-4-[4-[[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-[(4-nitro-1,3-dioxo-isoindolin-2-yl)methyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-[(4-nitro-1,3-dioxo-2-isoindolyl)methyl]-1-piperazinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-[(4-nitro-1,3-dioxoisoindol-2-yl)methyl]piperazin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 4-[4-[(1,3-diketo-4-nitro-isoindolin-2-yl)methyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C19H20N6O7S MolecularWeight: 476.4631

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=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O7S/c1-21-10-12(9-15(21)17(20)26)33(31,32)23-7-5-22(6-8-23)11-24-18(27)13-3-2-4-14(25(29)30)16(13)19(24)28/h2-4,9-10H,5-8,11H2,1H3,(H2,20,26)