Vitas-M small molecule compound
3-(hexylsulfanyl)-6-methyl-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STK509039
SMILES CCCCCCSc1nnc2c(n1)OC(C)Nc1c2cccc1
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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 C17H22N4OS MW 330.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4OS/c1-3-4-5-8-11-23-17-19-16-15(20-21-17)13-9-6-7-10-14(13)18-12(2)22-16/h6-7,9-10,12,18H,3-5,8,11H2,1-2H3InChIKey
ISSXLKGOHYHCEL-UHFFFAOYSA-NSynonyms
3(hexylsulfanyl)6methyl67dihydro(124)triazino(56d)(31)benzoxazepine
3HEXYLSULFANYL6METHYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCCCCCSC1=NC2=C(C3=CC=CC=C3NC(O2)C)N=N1
HEXYL6METHYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPIN3YLSULFIDE
InChI=1SC17H22N4OSc13458112317191615(202117)139671014(13)1812(2)2216h679101218H35811H212H3
MFCD02071085
ZINC000002073883
ZINC000002073884
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