Vitas-M small molecule compound

(2E)-3-{[2-(difluoromethoxy)phenyl]amino}-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile

Catalog ID
STL048519
SMILES N#C/C(=C\Nc1ccccc1OC(F)F)/c1scc(n1)c1ccc(cc1)[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 C19H12F2N4O3S MW 414.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12F2N4O3S/c20-19(21)28-17-4-2-1-3-15(17)23-10-13(9-22)18-24-16(11-29-18)12-5-7-14(8-6-12)25(26)27/h1-8,10-11,19,23H/b13-10+
InChIKey
SCOZFWHKZSONKS-JLHYYAGUSA-N
Synonyms
377051-47-3
(2E)3((2(difluoromethoxy)phenyl)amino)2(4(4nitrophenyl)13thiazol2yl)prop2enenitrile
(E)3((2(difluoromethoxy)phenyl)amino)2(4(4nitrophenyl)thiazol2yl)acrylonitrile
(E)3(2(DIFLUOROMETHOXY)ANILINO)2(4(4NITROPHENYL)13THIAZOL2YL)PROP2ENENITRILE
377051473
C1=CC=C(C(=C1)NC=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)(N+)(=O)(O))OC(F)F
InChI=1SC19H12F2N4O3Sc2019(21)2817421315(17)231013(922)182416(112918)125714(8612)25(26)27h1810111923Hb1310+
MFCD02982599
N#CC(=CNc1ccccc1OC(F)F)c1scc(n1)c1ccc(cc1)(N+)(=O)(O)
ZINC000009015565
ZINC09015565
ZINC9015565

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Available files

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