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(Q83037191)
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English
Ethanone, 1-(5,7-dimethyl-4-hydroxy-2-(3-(4-phenyl-1-piperazinyl)propyl)-2H-pyrido(3,2-e)(1,2)thiazin-3-yl)-, S,S-dioxide
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
470.19877644
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₄H₃₀N₄O₄S
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canonical SMILES
CC1=CC(=NC2=C1C(=C(N(S2(=O)=O)CCCN3CCN(CC3)C4=CC=CC=C4)C(=O)C)O)C
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Identifiers
InChI
InChI=1S/C24H30N4O4S/c1-17-16-18(2)25-24-21(17)23(30)22(19(3)29)28(33(24,31)32)11-7-10-26-12-14-27(15-13-26)20-8-5-4-6-9-20/h4-6,8-9,16,30H,7,10-15H2,1-3H3
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InChIKey
GJEOBPOSHHCJNC-UHFFFAOYSA-N
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CAS Registry Number
164357-31-7
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PubChem CID
3074851
1 reference
matched by identifier from
InChIKey
InChIKey
GJEOBPOSHHCJNC-UHFFFAOYSA-N
UniChem compound ID
33686463
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60167749
1 reference
matched by identifier from
InChIKey
InChIKey
GJEOBPOSHHCJNC-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID1090240
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