Vitas-M small molecule compound
6-(3,5-diiodo-2-methoxyphenyl)-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STL169913
SMILES CSc1nnc2c(n1)OC(Nc1c2cccc1)c1cc(I)cc(c1OC)I
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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 C18H14I2N4O2S MW 604.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14I2N4O2S/c1-25-15-11(7-9(19)8-12(15)20)16-21-13-6-4-3-5-10(13)14-17(26-16)22-18(27-2)24-23-14/h3-8,16,21H,1-2H3InChIKey
RWDKFEYWLSFLQX-UHFFFAOYSA-NSynonyms
6(35diiodo2methoxyphenyl)3(methylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
6(35DIIODO2METHOXYPHENYL)3METHYLSULFANYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
COC1=C(C=C(C=C1C2NC3=CC=CC=C3C4=C(O2)N=C(N=N4)SC)I)I
InChI=1SC18H14I2N4O2Sc1251511(79(19)812(15)20)162113643510(13)1417(2616)2218(272)242314h381621H12H3
MFCD01921532
ZINC000008443750
ZINC000008443751
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