Vitas-M small molecule compound
1-(5-formyl-2-oxo-3-propyl-2,3-dihydro-1,3-thiazol-4-yl)pyridinium
Catalog ID
STL348028
SMILES CCCn1c(=O)sc(c1[n+]1ccccc1)C=O
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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 C12H13N2O2S MW 249.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N2O2S/c1-2-6-14-11(10(9-15)17-12(14)16)13-7-4-3-5-8-13/h3-5,7-9H,2,6H2,1H3/q+1InChIKey
PPNPMDQALNQRCY-UHFFFAOYSA-NSynonyms
1(5FORMYL2OXO3PROPYL23DIHYDRO13THIAZOL4YL)PYRIDINIUM
2OXO3PROPYL4PYRIDIN1IUM1YL13THIAZOLE5CARBALDEHYDE
CCCN1C(=C(SC1=O)C=O)(N+)2=CC=CC=C2
CCCn1c(=O)sc(c1(n+)1ccccc1)C=O
InChI=1SC12H13N2O2Sc1261411(10(915)1712(14)16)137435813h3579H26H21H3q+1
ZINC05432460
ZINC5432460
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