Vitas-M small molecule compound
1-[3-(ethylsulfanyl)-6-(pyridin-2-yl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone
Catalog ID
STK521540
SMILES CCSc1nnc2c(n1)OC(c1ccccn1)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 C19H17N5O2S MW 379.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O2S/c1-3-27-19-21-17-16(22-23-19)13-8-4-5-10-15(13)24(12(2)25)18(26-17)14-9-6-7-11-20-14/h4-11,18H,3H2,1-2H3InChIKey
AGLKDZSHXGAOFP-UHFFFAOYSA-NSynonyms
1(3(ethylsulfanyl)6(pyridin2yl)(124)triazino(56d)(31)benzoxazepin7(6H)yl)ethanone
1(3ETHYLSULFANYL6PYRIDIN2YL6H(124)TRIAZINO(56D)(31)BENZOXAZEPIN7YL)ETHANONE
7ACETYL3(ETHYLTHIO)6(2PYRIDINYL)67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCSC1=NC2=C(C3=CC=CC=C3N(C(O2)C4=CC=CC=N4)C(=O)C)N=N1
InChI=1SC19H17N5O2Sc132719211716(222319)138451015(13)24(12(2)25)18(2617)14967112014h41118H3H212H3
MFCD03709341
ZINC000000795590
ZINC000000795591
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