Vitas-M small molecule compound
6-(2-bromo-4,5-dimethoxyphenyl)-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STL169755
SMILES COc1cc(C2Nc3ccccc3c3c(O2)nc(SC)nn3)c(cc1OC)Br
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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 C19H17BrN4O3S MW 461.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17BrN4O3S/c1-25-14-8-11(12(20)9-15(14)26-2)17-21-13-7-5-4-6-10(13)16-18(27-17)22-19(28-3)24-23-16/h4-9,17,21H,1-3H3InChIKey
VWYGYKZGLPZZOK-UHFFFAOYSA-NSynonyms
354544-51-7354544517
6(2bromo45dimethoxyphenyl)3(methylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
6(2BROMO45DIMETHOXYPHENYL)3METHYLSULFANYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
COC1=C(C=C(C(=C1)C2NC3=CC=CC=C3C4=C(O2)N=C(N=N4)SC)Br)OC
InChI=1SC19H17BrN4O3Sc12514811(12(20)915(14)262)172113754610(13)1618(2717)2219(283)242316h491721H13H3
MFCD01178058
ZINC000000688768
ZINC000000688769
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