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(Q83019255)
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English
ICI 207828
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
599.9518
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₄H₃₆BrClN₈O₃
0 references
canonical SMILES
CC(C)(C)C1=CC(=C(C(=C1)Br)O)CNCCNC(=O)CCN(C)CCNC(=O)C2=C(N=C(C(=N2)Cl)N)N
0 references
Identifiers
InChI
InChI=1S/C24H36BrClN8O3/c1-24(2,3)15-11-14(19(36)16(25)12-15)13-29-6-7-30-17(35)5-9-34(4)10-8-31-23(37)18-21(27)33-22(28)20(26)32-18/h11-12,29,36H,5-10,13H2,1-4H3,(H,30,35)(H,31,37)(H4,27,28,33)
0 references
InChIKey
OBRXFUXYWFFYJV-UHFFFAOYSA-N
0 references
CAS Registry Number
119778-11-9
0 references
PubChem CID
128967
1 reference
matched by identifier from
InChIKey
InChIKey
OBRXFUXYWFFYJV-UHFFFAOYSA-N
UniChem compound ID
25097700
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70152585
1 reference
matched by identifier from
InChIKey
InChIKey
OBRXFUXYWFFYJV-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID5075076
0 references
UNII
S4WU3D5ACT
1 reference
matched by identifier from
InChIKey
InChIKey
OBRXFUXYWFFYJV-UHFFFAOYSA-N
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