Vitas-M small molecule compound
6-(anthracen-9-yl)-3-(ethylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STL170777
SMILES CCSc1nnc2c(n1)OC(Nc1c2cccc1)c1c2ccccc2cc2c1cccc2
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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 C26H20N4OS MW 436.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N4OS/c1-2-32-26-28-25-23(29-30-26)20-13-7-8-14-21(20)27-24(31-25)22-18-11-5-3-9-16(18)15-17-10-4-6-12-19(17)22/h3-15,24,27H,2H2,1H3InChIKey
BPKKELWGFPWIKY-UHFFFAOYSA-NSynonyms
6(anthracen9yl)3(ethylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
6ANTHRACEN9YL3ETHYLSULFANYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=C5C=CC=CC5=CC6=CC=CC=C64)N=N1
InChI=1SC26H20N4OSc123226282523(293026)2013781421(20)2724(3125)22181153916(18)151710461219(17)22h3152427H2H21H3
MFCD01417332
ZINC000002736568
ZINC000002736569
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