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CHEBI:47717 - 1-METHYL ETHYL 1-CHLORO-5-[[(5,6DIHYDRO-2-METHYL-1,4-OXATHIIN-3-YL)CARBONYL]AMINO]BENZOATE

Default Structure
ChEBI IDCHEBI:47717
ChEBI Name1-METHYL ETHYL 1-CHLORO-5-[[(5,6DIHYDRO-2-METHYL-1,4-OXATHIIN-3-YL)CARBONYL]AMINO]BENZOATE
Stars
DownloadsMolfile
FormulaC16H18ClNO4S
Net Charge0
Average Mass355.843
Monoisotopic Mass355.06451
SMILES[H]c1c([H])c(N([H])C(=O)C2=C(C([H])([H])[H])OC([H])([H])C([H])([H])S2)c([H])c(C(=O)OC([H])(C([H])([H])[H])C([H])([H])[H])c1Cl
InChIInChI=1S/C16H18ClNO4S/c1-9(2)22-16(20)12-8-11(4-5-13(12)17)18-15(19)14-10(3)21-6-7-23-14/h4-5,8-9H,6-7H2,1-3H3,(H,18,19)
InChIKeyFMQGUMRNTBJHEA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-METHYL ETHYL 1-CHLORO-5-[[(5,6DIHYDRO-2-METHYL-1,4-OXATHIIN-3-YL)CARBONYL]AMINO]BENZOATE (CHEBI:47717) is a unclassifieds (CHEBI:27189)
Synonyms  Source
1-METHYL ETHYL 1-CHLORO-5-[[(5,6DIHYDRO-2-METHYL-1,4-OXATHIIN-3-YL)CARBONYL]AMINO]BENZOATEPDBeChem
1-methylethyl 2-chloro-5-{[(2-methyl-5,6-dihydro-1,4-oxathiin-3-yl)carbonyl]amino}benzoatePDBeChem
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