Vitas-M small molecule compound
ethyl [5-({[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetyl}amino)-1,3,4-thiadiazol-2-yl]acetate
Catalog ID
STK720091
SMILES CCOC(=O)Cc1nnc(s1)NC(=O)CSc1nnc2c(n1)n(C)c1c2cc(cc1)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 C18H16BrN7O3S2 MW 522.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrN7O3S2/c1-3-29-14(28)7-13-22-25-18(31-13)20-12(27)8-30-17-21-16-15(23-24-17)10-6-9(19)4-5-11(10)26(16)2/h4-6H,3,7-8H2,1-2H3,(H,20,25,27)InChIKey
APPIJVDUINERCM-UHFFFAOYSA-NSynonyms
682348-14-7682348147
CCOC(=O)CC1=NN=C(S1)NC(=O)CSC2=NC3=C(C4=C(N3C)C=CC(=C4)Br)N=N2
ethyl(5((((8bromo5methyl5H(124)triazino(56b)indol3yl)sulfanyl)acetyl)amino)134thiadiazol2yl)acetate
ETHYL2(5((2((8BROMO5METHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)134THIADIAZOL2YL)ACETATE
InChI=1SC18H16BrN7O3S2c132914(28)713222518(3113)2012(27)83017211615(232417)1069(19)4511(10)26(16)2h46H378H212H3(H202527)
MFCD03768091
ZINC000002746179
ZINC2746179
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