Vitas-M small molecule compound
(5E)-3-(2-methoxyphenyl)-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-2-thioxoimidazolidin-4-one
Catalog ID
STL171492
SMILES COc1ccccc1N1C(=S)N/C(=C/c2ccc(o2)c2ccc(cc2)[N+](=O)[O-])/C1=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 C21H15N3O5S MW 421.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O5S/c1-28-19-5-3-2-4-17(19)23-20(25)16(22-21(23)30)12-15-10-11-18(29-15)13-6-8-14(9-7-13)24(26)27/h2-12H,1H3,(H,22,30)/b16-12+InChIKey
ITSCLRFBBXLCNA-FOWTUZBSSA-NSynonyms
766531-60-6(5E)3(2methoxyphenyl)5((5(4nitrophenyl)furan2yl)methylidene)2sulfanylideneimidazolidin4one
(5E)3(2methoxyphenyl)5((5(4nitrophenyl)furan2yl)methylidene)2thioxoimidazolidin4one
766531606
COC1=CC=CC=C1N2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)(N+)(=O)(O))NC2=S
COc1ccccc1N1C(=S)NC(=Cc2ccc(o2)c2ccc(cc2)(N+)(=O)(O))C1=O
InChI=1SC21H15N3O5Sc12819532417(19)2320(25)16(2221(23)30)1215101118(2915)136814(9713)24(26)27h212H1H3(H2230)b1612+
MFCD04045240
ZINC000035669756
ZINC35669756
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