Vitas-M small molecule compound
(5Z)-5-(5-bromo-2,4-dimethoxybenzylidene)-3-(4-ethoxyphenyl)-1-methyl-2-thioxoimidazolidin-4-one
Catalog ID
STL378790
SMILES CCOc1ccc(cc1)N1C(=O)/C(=C/c2cc(Br)c(cc2OC)OC)/N(C1=S)C
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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 C21H21BrN2O4S MW 477.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN2O4S/c1-5-28-15-8-6-14(7-9-15)24-20(25)17(23(2)21(24)29)11-13-10-16(22)19(27-4)12-18(13)26-3/h6-12H,5H2,1-4H3/b17-11-InChIKey
HJOQYLAVGDSNQW-BOPFTXTBSA-NSynonyms
(5Z)5((5BROMO24DIMETHOXYPHENYL)METHYLIDENE)3(4ETHOXYPHENYL)1METHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(5bromo24dimethoxybenzylidene)3(4ethoxyphenyl)1methyl2thioxoimidazolidin4one
5(5BROMO24DIMETHOXYBENZYLIDENE)3(4ETHOXYPHENYL)1METHYL2THIOXOIMIDAZOLIDIN4ONE
CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3OC)OC)Br)N(C2=S)C
CCOc1ccc(cc1)N1C(=O)C(=Cc2cc(Br)c(cc2OC)OC)N(C1=S)C
InChI=1SC21H21BrN2O4Sc1528158614(7915)2420(25)17(23(2)21(24)29)11131016(22)19(274)1218(13)263h612H5H214H3b1711
MFCD03697184
ZINC000000661305
ZINC00661305
ZINC661305
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