Vitas-M small molecule compound
methyl 5-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]methyl}thiophene-2-carboxylate
Catalog ID
STL405053
SMILES COC(=O)c1ccc(s1)Cn1cnc2c(c1=O)cnn2c1ccc(cc1)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 C18H13FN4O3S MW 384.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13FN4O3S/c1-26-18(25)15-7-6-13(27-15)9-22-10-20-16-14(17(22)24)8-21-23(16)12-4-2-11(19)3-5-12/h2-8,10H,9H2,1H3InChIKey
MGHNWOFETZFILR-UHFFFAOYSA-NSynonyms
938005-20-0938005200
COC(=O)C1=CC=C(S1)CN2C=NC3=C(C2=O)C=NN3C4=CC=C(C=C4)F
InChI=1SC18H13FN4O3Sc12618(25)157613(2715)92210201614(17(22)24)82123(16)124211(19)3512h2810H9H21H3
methyl5((1(4fluorophenyl)4oxo14dihydro5Hpyrazolo(34d)pyrimidin5yl)methyl)thiophene2carboxylate
methyl5((1(4fluorophenyl)4oxopyrazolo(34d)pyrimidin5yl)methyl)thiophene2carboxylate
MFCD08556127
ZINC000036614682
ZINC36614682
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