Vitas-M small molecule compound
6-(3,5-dibromo-4-methoxyphenyl)-3-(ethylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STL169906
SMILES CCSc1nnc2c(n1)OC(Nc1c2cccc1)c1cc(Br)c(c(c1)Br)OC
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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 C19H16Br2N4O2S MW 524.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16Br2N4O2S/c1-3-28-19-23-18-15(24-25-19)11-6-4-5-7-14(11)22-17(27-18)10-8-12(20)16(26-2)13(21)9-10/h4-9,17,22H,3H2,1-2H3InChIKey
LAMIGNNJQPTSEI-UHFFFAOYSA-NSynonyms
6(35dibromo4methoxyphenyl)3(ethylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
6(35DIBROMO4METHOXYPHENYL)3ETHYLSULFANYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=CC(=C(C(=C4)Br)OC)Br)N=N1
InChI=1SC19H16Br2N4O2Sc132819231815(242519)11645714(11)2217(2718)10812(20)16(262)13(21)910h491722H3H212H3
MFCD01920942
ZINC000002085777
ZINC000002085778
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