Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-4,5-dimethyl-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK847638
SMILES Cc1c(C)[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 C12H11N3OS MW 245.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N3OS/c1-7-8(2)14-15(11(7)16)12-13-9-5-3-4-6-10(9)17-12/h3-6,14H,1-2H3InChIKey
ICRINYJHBYGDKB-UHFFFAOYSA-NSynonyms
890593-68-71BENZOTHIAZOL2YL34DIMETHYLPYRAZOL5OL
2(13benzothiazol2yl)45dimethyl12dihydro3Hpyrazol3one
2(13BENZOTHIAZOL2YL)45DIMETHYL1HPYRAZOL3ONE
2BENZOTHIAZOL2YL45DIMETHYL2HPYRAZOL3OL
890593687
CC1=C(NN(C1=O)C2=NC3=CC=CC=C3S2)C
Cc1c(C)(nH)n(c1=O)c1nc2c(s1)cccc2
InChI=1SC12H11N3OSc178(2)1415(11(7)16)12139534610(9)1712h3614H12H3
MFCD08731029
ZINC000017045383
ZINC100129765
ZINC17045383
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