2-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonylethyl]-5-methyl-isoindole-1,3-dione

Systemtic Name: 2-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonylethyl]-5-methyl-isoindole-1,3-dione Openeye Name: 2-[2-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonylethyl]-5-methyl-isoindoline-1,3-dione CAS Name: 2-[2-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]sulfonyl]ethyl]-5-methylisoindole-1,3-dione IUPAC Name: 2-[2-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonylethyl]-5-methylisoindole-1,3-dione Traditional Name: 2-[2-[4-(2-furoyl)piperazino]sulfonylethyl]-5-methyl-isoindoline-1,3-quinone Formula: C20H21N3O6S MolecularWeight: 431.46224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCS(=O)(=O)N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCS(=O)(=O)N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C20H21N3O6S/c1-14-4-5-15-16(13-14)19(25)23(18(15)24)10-12-30(27,28)22-8-6-21(7-9-22)20(26)17-3-2-11-29-17/h2-5,11,13H,6-10,12H2,1H3