Vitas-M small molecule compound
(2E)-2-(4-bromobenzylidene)-6-(4-propoxybenzyl)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK705918
SMILES CCCOc1ccc(cc1)Cc1nn2c(nc1=O)s/c(=C/c1ccc(cc1)Br)/c2=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 C22H18BrN3O3S MW 484.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrN3O3S/c1-2-11-29-17-9-5-14(6-10-17)12-18-20(27)24-22-26(25-18)21(28)19(30-22)13-15-3-7-16(23)8-4-15/h3-10,13H,2,11-12H2,1H3/b19-13+InChIKey
PCDXJZWYUSBRGV-CPNJWEJPSA-NSynonyms
(2E)2((4BROMOPHENYL)METHYLIDENE)6((4PROPOXYPHENYL)METHYL)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2E)2(4bromobenzylidene)6(4propoxybenzyl)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)2(4bromobenzylidene)6(4propoxybenzyl)2Hthiazolo(32b)(124)triazine37dione
CCCOC1=CC=C(C=C1)CC2=NN3C(=O)C(=CC4=CC=C(C=C4)Br)SC3=NC2=O
CCCOc1ccc(cc1)Cc1nn2c(nc1=O)sc(=Cc1ccc(cc1)Br)c2=O
InChI=1SC22H18BrN3O3Sc121129179514(61017)121820(27)242226(2518)21(28)19(3022)13153716(23)8415h31013H21112H21H3b1913+
MFCD06290926
ZINC000026779399
ZINC26779399
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