Vitas-M small molecule compound
(2Z)-3-(4-methoxy-3-nitrophenyl)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK528244
SMILES N#C/C(=C/c1ccc(c(c1)[N+](=O)[O-])OC)/c1scc(n1)c1cccc(c1)[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 C19H12N4O5S MW 408.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12N4O5S/c1-28-18-6-5-12(8-17(18)23(26)27)7-14(10-20)19-21-16(11-29-19)13-3-2-4-15(9-13)22(24)25/h2-9,11H,1H3/b14-7-InChIKey
NROREUVKSLFWQU-AUWJEWJLSA-NSynonyms
(2Z)3(4methoxy3nitrophenyl)2(4(3nitrophenyl)13thiazol2yl)prop2enenitrile
(Z)3(4METHOXY3NITROPHENYL)2(4(3NITROPHENYL)13THIAZOL2YL)PROP2ENENITRILE
(Z)3(4methoxy3nitrophenyl)2(4(3nitrophenyl)thiazol2yl)acrylonitrile
COC1=C(C=C(C=C1)C=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC19H12N4O5Sc128186512(817(18)23(26)27)714(1020)192116(112919)1332415(913)22(24)25h2911H1H3b147
MFCD01958852
N#CC(=Cc1ccc(c(c1)(N+)(=O)(O))OC)c1scc(n1)c1cccc(c1)(N+)(=O)(O)
ZINC000004827065
ZINC04827065
ZINC4827065
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