Vitas-M small molecule compound
(2Z)-2-{[3-(3-fluoro-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK816837
SMILES CCCOc1ccc(cc1F)c1nn(cc1/C=c/1\sc2n(c1=O)nc(c(=O)n2)C)c1ccccc1
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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 C25H20FN5O3S MW 489.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FN5O3S/c1-3-11-34-20-10-9-16(12-19(20)26)22-17(14-30(29-22)18-7-5-4-6-8-18)13-21-24(33)31-25(35-21)27-23(32)15(2)28-31/h4-10,12-14H,3,11H2,1-2H3/b21-13-InChIKey
ASOIFRUTMABEFJ-BKUYFWCQSA-NSynonyms
(2Z)2((3(3fluoro4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)6methyl7H(13)thiazolo(32b)(124)triazine37(2H)dione
(2Z)2((3(3FLUORO4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)6METHYL(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=O)C(=N4)C)S3)C5=CC=CC=C5)F
CCCOc1ccc(cc1F)c1nn(cc1C=c1sc2n(c1=O)nc(c(=O)n2)C)c1ccccc1
InChI=1SC25H20FN5O3Sc1311342010916(1219(20)26)2217(1430(2922)187546818)132124(33)3125(3521)2723(32)15(2)2831h4101214H311H212H3b2113
MFCD03534704
ZINC000016733756
ZINC16733756
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