Vitas-M small molecule compound
5-formyl-4-(isoquinolinium-2-yl)-1,3-thiazol-2-olate
Catalog ID
STL335439
SMILES O=Cc1sc(nc1[n+]1ccc2c(c1)cccc2)[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 C13H8N2O2S MW 256.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8N2O2S/c16-8-11-12(14-13(17)18-11)15-6-5-9-3-1-2-4-10(9)7-15/h1-8HInChIKey
PUZRGTDJHDZUID-UHFFFAOYSA-NSynonyms
85833-52-9(4ISOQUINOLIN2IUM2YL2OXO13THIAZOL5YLIDENE)METHANOLATE
(E)(4ISOQUINOLIN2IUM2YL2OXO13THIAZOL5YLIDENE)METHANOLATE
5formyl4(isoquinolin2ium2yl)thiazol2olate
5formyl4(isoquinolinium2yl)13thiazol2olate
85833529
C1=CC=C2C=(N+)(C=CC2=C1)C3=NC(=O)SC3=C(O)
InChI=1SC13H8N2O2Sc1681112(1413(17)1811)15659312410(9)715h18H
MFCD00583806
O=Cc1sc(nc1(n+)1ccc2c(c1)cccc2)(O)
ZINC000015973890
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