Vitas-M small molecule compound
ethyl 2-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrazole-4-carboxylate
Catalog ID
STK620877
SMILES CCOC(=O)c1c[nH]n(c1=O)c1nc2c(s1)cccc2
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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 C13H11N3O3S MW 289.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N3O3S/c1-2-19-12(18)8-7-14-16(11(8)17)13-15-9-5-3-4-6-10(9)20-13/h3-7,14H,2H2,1H3InChIKey
LBBIAZLQNVNRMM-UHFFFAOYSA-NSynonyms
1006661-02-41006661024
CCOC(=O)C1=CNN(C1=O)C2=NC3=CC=CC=C3S2
CCOC(=O)c1c(nH)n(c1=O)c1nc2c(s1)cccc2
ETHYL1BENZOTHIAZOL2YL5HYDROXYPYRAZOLE4CARBOXYLATE
ethyl2(13benzothiazol2yl)3oxo1Hpyrazole4carboxylate
ethyl2(13benzothiazol2yl)3oxo23dihydro1Hpyrazole4carboxylate
InChI=1SC13H11N3O3Sc121912(18)871416(11(8)17)13159534610(9)2013h3714H2H21H3
MFCD09794761
ZINC000102720238
ZINC09481854
ZINC102720238
ZINC9481854
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