Vitas-M small molecule compound
10-bromo-6-methyl-3-(prop-2-en-1-ylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STK980322
SMILES C=CCSc1nnc2c(n1)OC(=Nc1c2cc(Br)cc1)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 C14H11BrN4OS MW 363.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11BrN4OS/c1-3-6-21-14-17-13-12(18-19-14)10-7-9(15)4-5-11(10)16-8(2)20-13/h3-5,7H,1,6H2,2H3InChIKey
PXKFTWFDFUVUAX-UHFFFAOYSA-NSynonyms
10bromo6methyl3(prop2en1ylsulfanyl)(124)triazino(56d)(31)benzoxazepine
10BROMO6METHYL3PROP2ENYLSULFANYL(124)TRIAZINO(56D)(31)BENZOXAZEPINE
3(ALLYLTHIO)10BROMO6METHYL(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CC1=NC2=C(C=C(C=C2)Br)C3=C(O1)N=C(N=N3)SCC=C
InChI=1SC14H11BrN4OSc1362114171312(181914)1079(15)4511(10)168(2)2013h357H16H22H3
MFCD05994544
ZINC000005065496
ZINC05065496
ZINC5065496
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