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(Q72444962)
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English
Bendamustine
chemical compound
4-[5-[Bis(2-chloroethyl)amino]-1-methyl-benzimidazol-2-yl]butyric acid hydrochloride
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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chemical formula
C₁₆H₂₁Cl₂N₃O₂·HCl
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canonical SMILES
Cl.Cn1c(CCCC(=O)O)nc2cc(N(CCCl)CCCl)ccc21
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C16H21Cl2N3O2.ClH/c1-20-14-6-5-12(21(9-7-17)10-8-18)11-13(14)19-15(20)3-2-4-16(22)23;/h5-6,11H,2-4,7-10H2,1H3,(H,22,23);1H
0 references
InChIKey
ZHSKUOZOLHMKEA-UHFFFAOYSA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
97832-05-8
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SureChEMBL ID
SCHEMBL15436003
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZHSKUOZOLHMKEA-UHFFFAOYSA-N
SCHEMBL18843
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZHSKUOZOLHMKEA-UHFFFAOYSA-N
DSSTox substance ID
DTXSID40188912
1 reference
matched by identifier from
InChIKey
InChIKey
ZHSKUOZOLHMKEA-UHFFFAOYSA-N
UNII
981Y8SX18M
1 reference
matched by identifier from
InChIKey
InChIKey
ZHSKUOZOLHMKEA-UHFFFAOYSA-N
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