Vitas-M small molecule compound
(2Z)-2-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-5-methyl-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one
Catalog ID
STL181705
SMILES O=c1/c(=C/c2c(C)nn(c2Cl)c2ccccc2)/sc2=NC3(CC(n12)c1ccccc1O3)C
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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 C24H19ClN4O2S MW 462.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN4O2S/c1-14-17(21(25)29(27-14)15-8-4-3-5-9-15)12-20-22(30)28-18-13-24(2,26-23(28)32-20)31-19-11-7-6-10-16(18)19/h3-12,18H,13H2,1-2H3/b20-12-InChIKey
VOVZKQKWFOUKOA-NDENLUEZSA-NSynonyms
1263038-82-9(2Z)2((5chloro3methyl1phenyl1Hpyrazol4yl)methylidene)5methyl5H11H511methano(13)thiazolo(23d)(135)benzoxadiazocin1(2H)one
1263038829
CC1=NN(C(=C1C=C2C(=O)N3C4CC(N=C3S2)(OC5=CC=CC=C45)C)Cl)C6=CC=CC=C6
InChI=1SC24H19ClN4O2Sc11417(21(25)29(2714)158435915)122022(30)28181324(22623(28)3220)311911761016(18)19h31218H13H212H3b2012
MFCD20760079
O=c1c(=Cc2c(C)nn(c2Cl)c2ccccc2)sc2=NC3(CC(n12)c1ccccc1O3)C
ZINC000071785028
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