Vitas-M small molecule compound
3-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-8-nitro-2H-chromen-2-one
Catalog ID
STK549962
SMILES Cc1ccc(c(c1)C)c1csc(n1)c1cc2cccc(c2oc1=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 C20H14N2O4S MW 378.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N2O4S/c1-11-6-7-14(12(2)8-11)16-10-27-19(21-16)15-9-13-4-3-5-17(22(24)25)18(13)26-20(15)23/h3-10H,1-2H3InChIKey
FQVOQBVVALOVHA-UHFFFAOYSA-NSynonyms
683258-89-13(4(24dimethylphenyl)13thiazol2yl)8nitro2Hchromen2one
3(4(24DIMETHYLPHENYL)13THIAZOL2YL)8NITROCHROMEN2ONE
3(4(24dimethylphenyl)thiazol2yl)8nitro2Hchromen2one
683258891
CC1=CC(=C(C=C1)C2=CSC(=N2)C3=CC4=C(C(=CC=C4)(N+)(=O)(O))OC3=O)C
Cc1ccc(c(c1)C)c1csc(n1)c1cc2cccc(c2oc1=O)(N+)(=O)(O)
InChI=1SC20H14N2O4Sc1116714(12(2)811)16102719(2116)1591343517(22(24)25)18(13)2620(15)23h310H12H3
MFCD03672338
ZINC000002205690
ZINC02205690
ZINC2205690
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