Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-5-benzyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL357437
SMILES O=C1CC(=NN1c1nc2c(s1)cccc2)Cc1ccccc1
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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 C17H13N3OS MW 307.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3OS/c21-16-11-13(10-12-6-2-1-3-7-12)19-20(16)17-18-14-8-4-5-9-15(14)22-17/h1-9H,10-11H2InChIKey
CBYKVEQSTWBKQI-UHFFFAOYSA-NSynonyms
371948-34-41(benzo(d)thiazol2yl)3benzyl1Hpyrazol5(4H)one
2(13benzothiazol2yl)5benzyl24dihydro3Hpyrazol3one
2(13BENZOTHIAZOL2YL)5BENZYL4HPYRAZOL3ONE
371948344
C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)CC4=CC=CC=C4
InChI=1SC17H13N3OSc21161113(10126213712)1920(16)171814845915(14)2217h19H1011H2
MFCD01210575
ZINC000100700847
ZINC100700847
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