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(Q83101174)
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English
Quinazoline, 4-methyl-2-(((3-methylphenyl)thio)methyl)-, 3-oxide
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
296.098334132
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₁₆N₂OS
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canonical SMILES
CC1=CC(=CC=C1)SCC2=NC3=CC=CC=C3C(=[N+]2[O-])C
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Identifiers
InChI
InChI=1S/C17H16N2OS/c1-12-6-5-7-14(10-12)21-11-17-18-16-9-4-3-8-15(16)13(2)19(17)20/h3-10H,11H2,1-2H3
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InChIKey
ZBDZTMFSGSQQIB-UHFFFAOYSA-N
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CAS Registry Number
7251-55-0
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PubChem CID
479301
1 reference
matched by identifier from
InChIKey
InChIKey
ZBDZTMFSGSQQIB-UHFFFAOYSA-N
UniChem compound ID
13648453
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80222829
1 reference
matched by identifier from
InChIKey
InChIKey
ZBDZTMFSGSQQIB-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60145320
0 references
NSC number
64055
0 references
UNII
PSZ7R73RJY
1 reference
matched by identifier from
InChIKey
InChIKey
ZBDZTMFSGSQQIB-UHFFFAOYSA-N
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