Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-4-{(E)-[(3-methoxypropyl)imino]methyl}-5-propyl-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK687796
SMILES COCCC/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 C18H22N4O2S MW 358.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O2S/c1-3-7-14-13(12-19-10-6-11-24-2)17(23)22(21-14)18-20-15-8-4-5-9-16(15)25-18/h4-5,8-9,12,21H,3,6-7,10-11H2,1-2H3/b19-12+InChIKey
RFCOACKJKTXIJM-XDHOZWIPSA-NSynonyms
371937-76-72(13benzothiazol2yl)4((E)((3methoxypropyl)imino)methyl)5propyl12dihydro3Hpyrazol3one
371937767
COCCCN=Cc1c(CCC)(nH)n(c1=O)c1nc2c(s1)cccc2
MFCD01919681
ZINC000100163184
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