Vitas-M small molecule compound
2-{[5-(3,4-difluorophenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide
Catalog ID
STK985884
SMILES NC(=O)CSc1nc2[nH]ncc2c(=O)n1c1ccc(c(c1)F)F
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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 C13H9F2N5O2S MW 337.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9F2N5O2S/c14-8-2-1-6(3-9(8)15)20-12(22)7-4-17-19-11(7)18-13(20)23-5-10(16)21/h1-4H,5H2,(H2,16,21)(H,17,19)InChIKey
AXCNLUZUHSEARY-UHFFFAOYSA-NSynonyms
2((5(34difluorophenyl)4oxo1Hpyrazolo(34d)pyrimidin6yl)sulfanyl)acetamide
2((5(34difluorophenyl)4oxo45dihydro1Hpyrazolo(34d)pyrimidin6yl)sulfanyl)acetamide
C1=CC(=C(C=C1N2C(=O)C3=C(NN=C3)N=C2SCC(=O)N)F)F
InChI=1SC13H9F2N5O2Sc148216(39(8)15)2012(22)74171911(7)1813(20)23510(16)21h14H5H2(H21621)(H1719)
MFCD18182821
NC(=O)CSc1nc2(nH)ncc2c(=O)n1c1ccc(c(c1)F)F
ZINC000051316820
ZINC51316820
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