Vitas-M small molecule compound
(2E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(2-methoxy-5-nitrophenyl)prop-2-enenitrile
Catalog ID
STL042917
SMILES N#C/C(=C\c1cc(ccc1OC)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1)Cl
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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 C19H12ClN3O3S MW 397.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12ClN3O3S/c1-26-18-7-6-16(23(24)25)9-13(18)8-14(10-21)19-22-17(11-27-19)12-2-4-15(20)5-3-12/h2-9,11H,1H3/b14-8+InChIKey
JXYRCEJROYCVRA-RIYZIHGNSA-NSynonyms
683255-81-4(2E)2(4(4chlorophenyl)13thiazol2yl)3(2methoxy5nitrophenyl)prop2enenitrile
(E)2(4(4CHLOROPHENYL)13THIAZOL2YL)3(2METHOXY5NITROPHENYL)PROP2ENENITRILE
(E)2(4(4chlorophenyl)thiazol2yl)3(2methoxy5nitrophenyl)acrylonitrile
683255814
COC1=C(C=C(C=C1)(N+)(=O)(O))C=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)Cl
InChI=1SC19H12ClN3O3Sc126187616(23(24)25)913(18)814(1021)192217(112719)122415(20)5312h2911H1H3b148+
MFCD03672152
N#CC(=Cc1cc(ccc1OC)(N+)(=O)(O))c1scc(n1)c1ccc(cc1)Cl
ZINC000005023800
ZINC05023800
ZINC5023800
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