Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-4-{(E)-[(4-methoxybenzyl)imino]methyl}-5-propyl-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK741764
SMILES CCCc1[nH]n(c(=O)c1/C=N/Cc1ccc(cc1)OC)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 C22H22N4O2S MW 406.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O2S/c1-3-6-18-17(14-23-13-15-9-11-16(28-2)12-10-15)21(27)26(25-18)22-24-19-7-4-5-8-20(19)29-22/h4-5,7-12,14,25H,3,6,13H2,1-2H3/b23-14+InChIKey
QXUHIYCUWQWESL-OEAKJJBVSA-NSynonyms
371954-79-9(E)2(benzo(d)thiazol2yl)4(((4methoxybenzyl)imino)methyl)5propyl1Hpyrazol3(2H)one
2(13benzothiazol2yl)4((E)((4methoxybenzyl)imino)methyl)5propyl12dihydro3Hpyrazol3one
371954799
CCCc1(nH)n(c(=O)c1C=NCc1ccc(cc1)OC)c1nc2c(s1)cccc2
MFCD01811081
ZINC000100163123
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