Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-4-{(E)-[(3-hydroxypropyl)imino]methyl}-5-propyl-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK741766
SMILES OCCC/N=C/c1c(CCC)[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 C17H20N4O2S MW 344.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O2S/c1-2-6-13-12(11-18-9-5-10-22)16(23)21(20-13)17-19-14-7-3-4-8-15(14)24-17/h3-4,7-8,11,20,22H,2,5-6,9-10H2,1H3/b18-11+InChIKey
DAMYDQRNBSXMHZ-WOJGMQOQSA-NSynonyms
337341-58-9(E)2(benzo(d)thiazol2yl)4(((3hydroxypropyl)imino)methyl)5propyl1Hpyrazol3(2H)one
2(13benzothiazol2yl)4((E)((3hydroxypropyl)imino)methyl)5propyl12dihydro3Hpyrazol3one
337341589
MFCD01811084
OCCCN=Cc1c(CCC)(nH)n(c1=O)c1nc2c(s1)cccc2
ZINC000005061563
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