Vitas-M small molecule compound
(2Z)-3-[(4-ethylphenyl)amino]-2-[4-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK527520
SMILES N#C/C(=C/Nc1ccc(cc1)CC)/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/c1-2-14-3-5-17(6-4-14)25-12-16(11-24)22-26-20(13-32-22)19-10-15-9-18(27(29)30)7-8-21(15)31-23(19)28/h3-10,12-13,25H,2H2,1H3/b16-12-InChIKey
XKNBIJAEXHBWAI-VBKFSLOCSA-NSynonyms
373618-04-3(2Z)3((4ethylphenyl)amino)2(4(6nitro2oxo2Hchromen3yl)13thiazol2yl)prop2enenitrile
(Z)3((4ethylphenyl)amino)2(4(6nitro2oxo2Hchromen3yl)thiazol2yl)acrylonitrile
(Z)3(4ETHYLANILINO)2(4(6NITRO2OXOCHROMEN3YL)13THIAZOL2YL)PROP2ENENITRILE
373618043
CCC1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)(N+)(=O)(O))OC3=O
InChI=1SC23H16N4O4Sc12143517(6414)251216(1124)222620(133222)191015918(27(29)30)7821(15)3123(19)28h310121325H2H21H3b1612
MFCD01949115
N#CC(=CNc1ccc(cc1)CC)c1scc(n1)c1cc2cc(ccc2oc1=O)(N+)(=O)(O)
ZINC000001899948
ZINC01899948
ZINC1899948
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