Vitas-M small molecule compound
6-(5-bromothiophen-2-yl)-3-(propylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STL169794
SMILES CCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1ccc(s1)Br
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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 C17H15BrN4OS2 MW 435.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN4OS2/c1-2-9-24-17-20-16-14(21-22-17)10-5-3-4-6-11(10)19-15(23-16)12-7-8-13(18)25-12/h3-8,15,19H,2,9H2,1H3InChIKey
OQQIQNYGQUKWIE-UHFFFAOYSA-NSynonyms
6(5bromothiophen2yl)3(propylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
6(5bromothiophen2yl)3propylsulfanyl67dihydro(124)triazino(56d)(31)benzoxazepine
CCCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=CC=C(S4)Br)N=N1
InChI=1SC17H15BrN4OS2c1292417201614(212217)10534611(10)1915(2316)127813(18)2512h381519H29H21H3
MFCD01647756
ZINC000002741646
ZINC000002741647
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