but-2-enedioic acid; 3-(4-methylpiperazin-1-yl)-6-thiabicyclo[5.4.0]undeca-7,9,11-trien-2-one
Molecular Formula:
C23H28N2O9S
InChI: InChI=1/C15H20N2OS.2C4H4O4/c1-16-7-9-17(10-8-16)13-6-11-19-14-5-3-2-4-12(14)15(13)18;2*5-3(6)1-2-4(7)8/h2-5,13H,6-11H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-/f/h;2*5,7H
InChIKey: InChIKey=AZVURJKDMXIBLU-LCYOARCZDR
SMILES: CN1CCN(CC1)C2CCSC3=CC=CC=C3C2=O.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O
Names:
but-2-enedioic acid; 3-(4-methylpiperazin-1-yl)-6-thiabicyclo[5.4.0]undeca-7,9,11-trien-2-one
Registries:
PubChem CID 6433793
PubChem ID 11620631
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