CHEBI:113151 - 2-[2-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]imino-6-sulfamoyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester

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ChEBI Name 2-[2-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]imino-6-sulfamoyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester
ChEBI ID CHEBI:113151
Stars This entity has been manually annotated by a third party.
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Formula C20H16ClN3O5S3
Net Charge 0
Average Mass 510.010
Monoisotopic Mass 508.99406
InChI InChI=1S/C20H16ClN3O5S3/c1-2-29-16(25)10-24-13-8-7-11(32(22,27)28)9-15(13)31-20(24)23-19(26)18-17(21)12-5-3-4-6-14(12)30-18/h3-9H,2,10H2,1H3,(H2,22,27,28)
InChIKey PFUIZHAZQWAOBU-UHFFFAOYSA-N
SMILES CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3=C(C4=CC=CC=C4S3)Cl
ChEBI Ontology
Outgoing 2-[2-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]imino-6-sulfamoyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester (CHEBI:113151) is a α-amino acid ester (CHEBI:46874)
Manual Xref Database
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