Vitas-M small molecule compound
6-(3-chlorophenyl)-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STK326150
SMILES CSc1nnc2c(n1)OC(Nc1c2cccc1)c1cccc(c1)Cl
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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 C17H13ClN4OS MW 356.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN4OS/c1-24-17-20-16-14(21-22-17)12-7-2-3-8-13(12)19-15(23-16)10-5-4-6-11(18)9-10/h2-9,15,19H,1H3InChIKey
PYFJHCZWCKXLHL-UHFFFAOYSA-NSynonyms
6(3chlorophenyl)3(methylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
6(3chlorophenyl)3methylsulfanyl67dihydro(124)triazino(56d)(31)benzoxazepine
CSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=CC(=CC=C4)Cl)N=N1
InChI=1SC17H13ClN4OSc12417201614(212217)12723813(12)1915(2316)1054611(18)910h291519H1H3
MFCD00609049
ZINC000003207836
ZINC000003207839
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