Vitas-M small molecule compound
(2E)-3-(4-nitrophenyl)-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK788467
SMILES N#C/C(=C\c1ccc(cc1)[N+](=O)[O-])/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 C21H11N3O4S MW 401.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11N3O4S/c22-11-15(9-13-5-7-16(8-6-13)24(26)27)20-23-18(12-29-20)17-10-14-3-1-2-4-19(14)28-21(17)25/h1-10,12H/b15-9+InChIKey
AJRFVBUEDXJLJW-OQLLNIDSSA-NSynonyms
210287-78-8(2E)3(4nitrophenyl)2(4(2oxo2Hchromen3yl)13thiazol2yl)prop2enenitrile
(E)3(4nitrophenyl)2(4(2oxo2Hchromen3yl)thiazol2yl)acrylonitrile
(E)3(4NITROPHENYL)2(4(2OXOCHROMEN3YL)13THIAZOL2YL)PROP2ENENITRILE
210287788
C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)C(=CC4=CC=C(C=C4)(N+)(=O)(O))C#N
InChI=1SC21H11N3O4Sc221115(9135716(8613)24(26)27)202318(122920)171014312419(14)2821(17)25h11012Hb159+
MFCD00340093
N#CC(=Cc1ccc(cc1)(N+)(=O)(O))c1scc(n1)c1cc2ccccc2oc1=O
ZINC000004836793
ZINC04836793
ZINC4836793
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