Vitas-M small molecule compound
3-(ethylsulfanyl)-6-methyl[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STK509564
SMILES CCSc1nnc2c(n1)OC(=Nc1c2cccc1)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 C13H12N4OS MW 272.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4OS/c1-3-19-13-15-12-11(16-17-13)9-6-4-5-7-10(9)14-8(2)18-12/h4-7H,3H2,1-2H3InChIKey
HFFPTKUHUMAYAZ-UHFFFAOYSA-NSynonyms
3(ethylsulfanyl)6methyl(124)triazino(56d)(31)benzoxazepine
3ETHYLSULFANYL6METHYL(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCSC1=NC2=C(C3=CC=CC=C3N=C(O2)C)N=N1
InChI=1SC13H12N4OSc131913151211(161713)9645710(9)148(2)1812h47H3H212H3
MFCD07188781
ZINC000004502644
ZINC04502644
ZINC4502644
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