Vitas-M small molecule compound
1-[3-(ethylsulfanyl)-6-methyl[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone
Catalog ID
STK521371
SMILES CCSc1nnc2c(n1)OC(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 C15H16N4O2S MW 316.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O2S/c1-4-22-15-16-14-13(17-18-15)11-7-5-6-8-12(11)19(9(2)20)10(3)21-14/h5-8,10H,4H2,1-3H3InChIKey
PEQLWCLQBCCQNG-UHFFFAOYSA-NSynonyms
1(3(ethylsulfanyl)6methyl(124)triazino(56d)(31)benzoxazepin7(6H)yl)ethanone
1(3ETHYLSULFANYL6METHYL6H(124)TRIAZINO(56D)(31)BENZOXAZEPIN7YL)ETHANONE
CCSC1=NC2=C(C3=CC=CC=C3N(C(O2)C)C(=O)C)N=N1
InChI=1SC15H16N4O2Sc142215161413(171815)11756812(11)19(9(2)20)10(3)2114h5810H4H213H3
MFCD02377298
ZINC000000206163
ZINC000000206164
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