Vitas-M small molecule compound
2-[(3-methoxy-4-nitro-1H-pyrazol-1-yl)methyl]-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK306137
SMILES COc1nn(cc1[N+](=O)[O-])Cc1nn2c(n1)c1c(nc2)sc2c1CCC2
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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 C15H13N7O3S MW 371.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N7O3S/c1-25-14-9(22(23)24)5-20(19-14)6-11-17-13-12-8-3-2-4-10(8)26-15(12)16-7-21(13)18-11/h5,7H,2-4,6H2,1H3InChIKey
LBMQHBYXIKYFPI-UHFFFAOYSA-NSynonyms
1005698-64-51005698645
2((3methoxy4nitro1Hpyrazol1yl)methyl)910dihydro8Hcyclopenta(45)thieno(32e)(124)triazolo(15c)pyrimidine
COC1=NN(C=C1(N+)(=O)(O))CC2=NN3C=NC4=C(C3=N2)C5=C(S4)CCC5
COc1nn(cc1(N+)(=O)(O))Cc1nn2c(n1)c1c(nc2)sc2c1CCC2
InChI=1SC15H13N7O3Sc125149(22(23)24)520(1914)611171312832410(8)2615(12)16721(13)1811h57H246H21H3
MFCD04051066
ZINC000002788781
ZINC02788781
ZINC2788781
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