CHEBI:82218 - Sulfallate

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ChEBI Name Sulfallate ChEBI ID CHEBI:82218 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 C8H14ClNS2 Net Charge 0 Average Mass 223.78600 Monoisotopic Mass 223.02562 InChI InChI=1S/C8H14ClNS2/c1-4-10(5-2)8(11)12-6-7(3)9/h3-6H2,1-2H3 InChIKey XJCLWVXTCRQIDI-UHFFFAOYSA-N SMILES CCN(CC)C(=S)SCC(Cl)=C ChEBI Ontology Outgoing Sulfallate (CHEBI:82218) is a thiocarbonyl compound (CHEBI:50492) Manual Xrefs Databases 2589 PPDB C19096 KEGG COMPOUND View more database links Registry Number Type Source 95-06-7 CAS Registry Number KEGG COMPOUND