Vitas-M small molecule compound
4-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-7-ium-2-yl)-2,6-diiodophenolate
Catalog ID
STK561175
SMILES C[NH+]1CCc2c(C1)sc1c2C(=NC(N1)c1cc(I)c(c(c1)I)[O-])O
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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 C16H15I2N3O2S MW 567.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15I2N3O2S/c1-21-3-2-8-11(6-21)24-16-12(8)15(23)19-14(20-16)7-4-9(17)13(22)10(18)5-7/h4-5,14,20,22H,2-3,6H2,1H3,(H,19,23)InChIKey
JUCNUPIMBCNBGY-UHFFFAOYSA-NSynonyms
4(4hydroxy7methyl125678hexahydropyrido(4345)thieno(23d)pyrimidin7ium2yl)26diiodophenolate
C(NH+)1CCc2c(C1)sc1c2C(=NC(N1)c1cc(I)c(c(c1)I)(O))O
MFCD18187251
ZINC000102501994
ZINC000102501998
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