Vitas-M small molecule compound
6-(2-chlorobenzyl)-1-ethyl-3-methyl-5-thioxo-1,4,5,6-tetrahydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Catalog ID
STL104057
SMILES CCn1nc(c2c1c(=O)n(Cc1ccccc1Cl)c(=S)[nH]2)C
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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 C15H15ClN4OS MW 334.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15ClN4OS/c1-3-20-13-12(9(2)18-20)17-15(22)19(14(13)21)8-10-6-4-5-7-11(10)16/h4-7H,3,8H2,1-2H3,(H,17,22)InChIKey
WXPCVHIKZYSKIR-UHFFFAOYSA-NSynonyms
1031558-01-61031558016
6((2chlorophenyl)methyl)1ethyl3methyl5sulfanylidene4Hpyrazolo(43d)pyrimidin7one
6(2chlorobenzyl)1ethyl3methyl5thioxo1456tetrahydro7Hpyrazolo(43d)pyrimidin7one
CCN1C2=C(C(=N1)C)NC(=S)N(C2=O)CC3=CC=CC=C3Cl
CCn1nc(c2c1c(=O)n(Cc1ccccc1Cl)c(=S)(nH)2)C
InChI=1SC15H15ClN4OSc13201312(9(2)1820)1715(22)19(14(13)21)810645711(10)16h47H38H212H3(H1722)
MFCD14728454
ZINC000101151742
ZINC101151742
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