Vitas-M small molecule compound
N-(4-bromo-2-fluorophenyl)-6-(4-ethoxyphenyl)-3-methyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL358957
SMILES CCOc1ccc(cc1)C1Nn2c(SC1C(=O)Nc1ccc(cc1F)Br)nnc2C
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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 C20H19BrFN5O2S MW 492.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrFN5O2S/c1-3-29-14-7-4-12(5-8-14)17-18(30-20-25-24-11(2)27(20)26-17)19(28)23-16-9-6-13(21)10-15(16)22/h4-10,17-18,26H,3H2,1-2H3,(H,23,28)InChIKey
CBWXSSYRCPCWML-UHFFFAOYSA-NSynonyms
874586-45-5874586455
CCOC1=CC=C(C=C1)C2C(SC3=NN=C(N3N2)C)C(=O)NC4=C(C=C(C=C4)Br)F
InChI=1SC20H19BrFN5O2Sc1329147412(5814)1718(3020252411(2)27(20)2617)19(28)23169613(21)1015(16)22h410171826H3H212H3(H2328)
MFCD07433449
N(4bromo2fluorophenyl)6(4ethoxyphenyl)3methyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009238969
ZINC000009238972
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