(Q83030737)

English

Benzonitrile, 2-((5-((2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)amino)-2,4-dinitrophenyl)amino)-

chemical compound

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Statements

type of chemical entity

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chemical compound

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496.152888868 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₃H₂₄N₆O₅S

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canonical SMILES

CN(C)CC1=CC=C(O1)CSCCNC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])NC3=CC=CC=C3C#N

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Identifiers

InChI=1S/C23H24N6O5S/c1-27(2)14-17-7-8-18(34-17)15-35-10-9-25-20-11-21(23(29(32)33)12-22(20)28(30)31)26-19-6-4-3-5-16(19)13-24/h3-8,11-12,25-26H,9-10,14-15H2,1-2H3

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MVJGXHDGHVCSQW-UHFFFAOYSA-N

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CAS Registry Number

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1 reference

matched by identifier from

MVJGXHDGHVCSQW-UHFFFAOYSA-N

UniChem compound ID

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DSSTox substance ID

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matched by identifier from

MVJGXHDGHVCSQW-UHFFFAOYSA-N

DSSTOX compound identifier

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