Vitas-M small molecule compound
1-[6-(2-chloro-6-fluorophenyl)-3-(methylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone
Catalog ID
STK509327
SMILES CSc1nnc2c(n1)OC(c1c(F)cccc1Cl)N(c1c2cccc1)C(=O)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 C19H14ClFN4O2S MW 416.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14ClFN4O2S/c1-10(26)25-14-9-4-3-6-11(14)16-17(22-19(28-2)24-23-16)27-18(25)15-12(20)7-5-8-13(15)21/h3-9,18H,1-2H3InChIKey
RMAWBAYXJWJGDW-UHFFFAOYSA-NSynonyms
1(6(2chloro6fluorophenyl)3(methylsulfanyl)(124)triazino(56d)(31)benzoxazepin7(6H)yl)ethanone
1(6(2CHLORO6FLUOROPHENYL)3METHYLSULFANYL6H(124)TRIAZINO(56D)(31)BENZOXAZEPIN7YL)ETHANONE
CC(=O)N1C(OC2=C(C3=CC=CC=C31)N=NC(=N2)SC)C4=C(C=CC=C4Cl)F
InChI=1SC19H14ClFN4O2Sc110(26)2514943611(14)1617(2219(282)242316)2718(25)1512(20)75813(15)21h3918H12H3
MFCD02376450
ZINC000001184875
ZINC000009804775
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