CHEBI:107126 - 5-anilino-3-oxo-4-isothiazolecarbonitrile

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ChEBI Name 5-anilino-3-oxo-4-isothiazolecarbonitrile ChEBI ID CHEBI:107126 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C10H7N3OS Net Charge 0 Average Mass 217.249 Monoisotopic Mass 217.03098 InChI InChI=1S/C10H7N3OS/c11-6-8-9(14)13-15-10(8)12-7-4-2-1-3-5-7/h1-5,12H,(H,13,14) InChIKey GHXPCAXQBVCFNU-UHFFFAOYSA-N SMILES C1=CC=C(C=C1)NC2=C(C(=O)NS2)C#N Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) View more via ChEBI Ontology ChEBI Ontology Outgoing 5-anilino-3-oxo-4-isothiazolecarbonitrile (CHEBI:107126) is a substituted aniline (CHEBI:48975) Manual Xref Database LSM-18480 LINCS View more database links