Vitas-M small molecule compound
1-[6-(6-methylpyridin-2-yl)-3-(prop-2-en-1-ylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone
Catalog ID
STK521102
SMILES C=CCSc1nnc2c(n1)OC(c1cccc(n1)C)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 C21H19N5O2S MW 405.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O2S/c1-4-12-29-21-23-19-18(24-25-21)15-9-5-6-11-17(15)26(14(3)27)20(28-19)16-10-7-8-13(2)22-16/h4-11,20H,1,12H2,2-3H3InChIKey
VMUOVXRTOXQVKF-UHFFFAOYSA-NSynonyms
1(6(6methylpyridin2yl)3(prop2en1ylsulfanyl)(124)triazino(56d)(31)benzoxazepin7(6H)yl)ethanone
1(6(6METHYLPYRIDIN2YL)3PROP2ENYLSULFANYL6H(124)TRIAZINO(56D)(31)BENZOXAZEPIN7YL)ETHANONE
7ACETYL3(ALLYLSULFANYL)6(6METHYL2PYRIDINYL)67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CC1=CC=CC(=N1)C2N(C3=CC=CC=C3C4=C(O2)N=C(N=N4)SCC=C)C(=O)C
InChI=1SC21H19N5O2Sc14122921231918(242521)159561117(15)26(14(3)27)20(2819)16107813(2)2216h41120H112H223H3
MFCD02952121
ZINC000002113692
ZINC000002113694
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