N,N-diethyl-3-[[[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[[[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N,N-diethyl-3-[[(2-methyl-1,3-dioxo-isoindoline-5-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: N,N-diethyl-3-[[[(2-methyl-1,3-dioxo-5-isoindolyl)-oxomethyl]hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[[(2-methyl-1,3-dioxoisoindole-5-carbonyl)amino]carbamoyl]benzenesulfonamide Traditional Name: 3-[[(1,3-diketo-2-methyl-isoindoline-5-carbonyl)amino]carbamoyl]-N,N-diethyl-benzenesulfonamide Formula: C21H22N4O6S MolecularWeight: 458.48758

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C

InChI

InChI=1S/C21H22N4O6S/c1-4-25(5-2)32(30,31)15-8-6-7-13(11-15)18(26)22-23-19(27)14-9-10-16-17(12-14)21(29)24(3)20(16)28/h6-12H,4-5H2,1-3H3,(H,22,26)(H,23,27)