Vitas-M small molecule compound
2-amino-3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-1,3-thiazol-3-ium
Catalog ID
STL264523
SMILES O=C(c1ccc2c(c1)OCCO2)C[n+]1ccsc1N
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H13N2O3S MW 277.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N2O3S/c14-13-15(3-6-19-13)8-10(16)9-1-2-11-12(7-9)18-5-4-17-11/h1-3,6-7,14H,4-5,8H2/p+1InChIKey
BIZHCCKIHNCYJN-UHFFFAOYSA-OSynonyms
1(2H3HBENZO(34E)14DIOXAN6YL)2(2AMINO(13THIAZOL3YL))ETHAN1ONE
2(2AMINO13THIAZOL3IUM3YL)1(23DIHYDRO14BENZODIOXIN6YL)ETHANONE
2amino3(2(23dihydro14benzodioxin6yl)2oxoethyl)13thiazol3ium
C1COC2=C(O1)C=CC(=C2)C(=O)C(N+)3=C(SC=C3)N
InChI=1SC13H12N2O3Sc141315(361913)810(16)9121112(79)18541711h136714H458H2p+1
O=C(c1ccc2c(c1)OCCO2)C(n+)1ccsc1N
ZINC01814751
ZINC1814751
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