Vitas-M small molecule compound
(2E)-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-{[2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl]amino}prop-2-enenitrile
Catalog ID
STK536601
SMILES N#C/C(=C\Nc1ccc2c(c1)oc(=O)cc2C(F)(F)F)/c1scc(n1)c1cc2ccccc2oc1=O
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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 C25H12F3N3O4S MW 507.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H12F3N3O4S/c26-25(27,28)18-9-22(32)34-21-8-15(5-6-16(18)21)30-11-14(10-29)23-31-19(12-36-23)17-7-13-3-1-2-4-20(13)35-24(17)33/h1-9,11-12,30H/b14-11+InChIKey
PDKCUGJUAWVQFS-SDNWHVSQSA-NSynonyms
(2E)2(4(2oxo2Hchromen3yl)13thiazol2yl)3((2oxo4(trifluoromethyl)2Hchromen7yl)amino)prop2enenitrile
(E)2(4(2oxo2Hchromen3yl)thiazol2yl)3((2oxo4(trifluoromethyl)2Hchromen7yl)amino)acrylonitrile
(E)2(4(2OXOCHROMEN3YL)13THIAZOL2YL)3((2OXO4(TRIFLUOROMETHYL)CHROMEN7YL)AMINO)PROP2ENENITRILE
C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)C(=CNC4=CC5=C(C=C4)C(=CC(=O)O5)C(F)(F)F)C#N
InChI=1SC25H12F3N3O4Sc2625(2728)18922(32)3421815(5616(18)21)301114(1029)233119(123623)17713312420(13)3524(17)33h19111230Hb1411+
MFCD02984210
N#CC(=CNc1ccc2c(c1)oc(=O)cc2C(F)(F)F)c1scc(n1)c1cc2ccccc2oc1=O
ZINC000001771302
ZINC01771302
ZINC1771302
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