Vitas-M small molecule compound
(2E)-3-[(4-methoxy-2-nitrophenyl)amino]-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK537680
SMILES N#C/C(=C\Nc1ccc(cc1[N+](=O)[O-])OC)/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 C22H14N4O5S MW 446.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14N4O5S/c1-30-15-6-7-17(19(9-15)26(28)29)24-11-14(10-23)21-25-18(12-32-21)16-8-13-4-2-3-5-20(13)31-22(16)27/h2-9,11-12,24H,1H3/b14-11+InChIKey
SDXDAOKJGSJLSL-SDNWHVSQSA-NSynonyms
(2E)3((4methoxy2nitrophenyl)amino)2(4(2oxo2Hchromen3yl)13thiazol2yl)prop2enenitrile
(E)3((4methoxy2nitrophenyl)amino)2(4(2oxo2Hchromen3yl)thiazol2yl)acrylonitrile
(E)3(4METHOXY2NITROANILINO)2(4(2OXOCHROMEN3YL)13THIAZOL2YL)PROP2ENENITRILE
COC1=CC(=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=CC=CC=C4OC3=O)(N+)(=O)(O)
InChI=1SC22H14N4O5Sc130156717(19(915)26(28)29)241114(1023)212518(123221)16813423520(13)3122(16)27h29111224H1H3b1411+
MFCD02983679
N#CC(=CNc1ccc(cc1(N+)(=O)(O))OC)c1scc(n1)c1cc2ccccc2oc1=O
ZINC000009045040
ZINC09045040
ZINC9045040
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