Vitas-M small molecule compound
(2E)-3-[(2-ethylphenyl)amino]-2-[4-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK529931
SMILES N#C/C(=C\Nc1ccccc1CC)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[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 C23H16N4O4S MW 444.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N4O4S/c1-2-14-5-3-4-6-19(14)25-12-16(11-24)22-26-20(13-32-22)18-10-15-9-17(27(29)30)7-8-21(15)31-23(18)28/h3-10,12-13,25H,2H2,1H3/b16-12+InChIKey
OJEOAJGVRQBKLA-FOWTUZBSSA-NSynonyms
374096-89-6(2E)3((2ethylphenyl)amino)2(4(6nitro2oxo2Hchromen3yl)13thiazol2yl)prop2enenitrile
(E)3((2ethylphenyl)amino)2(4(6nitro2oxo2Hchromen3yl)thiazol2yl)acrylonitrile
(E)3(2ETHYLANILINO)2(4(6NITRO2OXOCHROMEN3YL)13THIAZOL2YL)PROP2ENENITRILE
374096896
CCC1=CC=CC=C1NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)(N+)(=O)(O))OC3=O
InChI=1SC23H16N4O4Sc1214534619(14)251216(1124)222620(133222)181015917(27(29)30)7821(15)3123(18)28h310121325H2H21H3b1612+
MFCD01951890
N#CC(=CNc1ccccc1CC)c1scc(n1)c1cc2cc(ccc2oc1=O)(N+)(=O)(O)
ZINC000008927825
ZINC08927825
ZINC8927825
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