API0232022
Thiothixene
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CAS No.
5591-45-7
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Synonyms
thiothixene; cis-Thiothixene; Tiotixene
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CHEMBL ID
CHEMBL1201
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Molecule Type
Small molecule
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Compound CID
941651
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Molecular Weight (g/mol)
443.6
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Molecular Formula
C23H29N3O2S2
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InChI
InChI=1S/C23H29N3O2S2/c1-24(2)30(27,28)18-10-11-23-21(17-18)19(20-7-4-5-9-22(20)29-23)8-6-12-26-15-13-25(3)14-16-26/h4-5,7-11,17H,6,12-16H2,1-3H3/b19-8-
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InChIKey
GFBKORZTTCHDGY-UWVJOHFNSA-N
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SMILES
CN1CCN(CC1)CC/C=C\2/C3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C
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IUPAC Name
(9Z)-N,N-dimethyl-9-[3-(4-methylpiperazin-1-yl)propylidene]thioxanthene-2-sulfonamide
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Exact Mass (Da)
443.17011952
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Monoisotopic Mass (Da)
443.17011952
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