Vitas-M small molecule compound
(2E)-2-[4-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-{[2-(propan-2-yl)phenyl]amino}prop-2-enenitrile
Catalog ID
STK527557
SMILES N#C/C(=C\Nc1ccccc1C(C)C)/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 C24H18N4O4S MW 458.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N4O4S/c1-14(2)18-5-3-4-6-20(18)26-12-16(11-25)23-27-21(13-33-23)19-10-15-9-17(28(30)31)7-8-22(15)32-24(19)29/h3-10,12-14,26H,1-2H3/b16-12+InChIKey
RFEKMFBPGODHQG-FOWTUZBSSA-NSynonyms
372979-36-7(2E)2(4(6nitro2oxo2Hchromen3yl)13thiazol2yl)3((2(propan2yl)phenyl)amino)prop2enenitrile
(E)2(4(6NITRO2OXOCHROMEN3YL)13THIAZOL2YL)3(2PROPAN2YLANILINO)PROP2ENENITRILE
(E)3((2isopropylphenyl)amino)2(4(6nitro2oxo2Hchromen3yl)thiazol2yl)acrylonitrile
372979367
CC(C)C1=CC=CC=C1NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)(N+)(=O)(O))OC3=O
InChI=1SC24H18N4O4Sc114(2)18534620(18)261216(1125)232721(133323)191015917(28(30)31)7822(15)3224(19)29h310121426H12H3b1612+
MFCD01954383
N#CC(=CNc1ccccc1C(C)C)c1scc(n1)c1cc2cc(ccc2oc1=O)(N+)(=O)(O)
ZINC000009315342
ZINC09315342
ZINC9315342
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