Vitas-M small molecule compound
methyl (2Z)-3-oxo-2-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}-2,3-dihydro-1-benzofuran-5-carboxylate
Catalog ID
STK819513
SMILES COC(=O)c1ccc2c(c1)C(=O)/C(=C/c1cn(nc1c1cccs1)c1ccccc1)/O2
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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 C24H16N2O4S MW 428.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16N2O4S/c1-29-24(28)15-9-10-19-18(12-15)23(27)20(30-19)13-16-14-26(17-6-3-2-4-7-17)25-22(16)21-8-5-11-31-21/h2-14H,1H3/b20-13-InChIKey
REEPVHFGHHQHDO-MOSHPQCFSA-NSynonyms
957014-35-6957014356
COC(=O)C1=CC2=C(C=C1)OC(=CC3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5)C2=O
COC(=O)c1ccc2c(c1)C(=O)C(=Cc1cn(nc1c1cccs1)c1ccccc1)O2
InChI=1SC24H16N2O4Sc12924(28)159101918(1215)23(27)20(3019)13161426(176324717)2522(16)2185113121h214H1H3b2013
methyl(2Z)3oxo2((1phenyl3(thiophen2yl)1Hpyrazol4yl)methylidene)23dihydro1benzofuran5carboxylate
METHYL(2Z)3OXO2((1PHENYL3THIOPHEN2YLPYRAZOL4YL)METHYLIDENE)1BENZOFURAN5CARBOXYLATE
MFCD04448454
ZINC000002704827
ZINC02704827
ZINC2704827
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