Vitas-M small molecule compound
7-methyl-2-(6-nitro-1,3-benzodioxol-5-yl)-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK746025
SMILES CN1CCc2c(C1)sc1c2C(=NC(N1)c1cc2OCOc2cc1[N+](=O)[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 C17H16N4O5S MW 388.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O5S/c1-20-3-2-8-13(6-20)27-17-14(8)16(22)18-15(19-17)9-4-11-12(26-7-25-11)5-10(9)21(23)24/h4-5,15,19H,2-3,6-7H2,1H3,(H,18,22)InChIKey
AXZKTRBBTDORCU-UHFFFAOYSA-NSynonyms
353461-95-7353461957
7methyl2(6nitro13benzodioxol5yl)123568hexahydropyrido(23)thieno(24d)pyrimidin4one
7methyl2(6nitro13benzodioxol5yl)125678hexahydropyrido(4345)thieno(23d)pyrimidin4ol
CN1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC5=C(C=C4(N+)(=O)(O))OCO5
CN1CCc2c(C1)sc1c2C(=NC(N1)c1cc2OCOc2cc1(N+)(=O)(O))O
InChI=1SC17H16N4O5Sc12032813(620)271714(8)16(22)1815(1917)941112(2672511)510(9)21(23)24h451519H2367H21H3(H1822)
MFCD03814223
ZINC000006857615
ZINC000006857663
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