Vitas-M small molecule compound

(2Z)-2-{[3-(3-fluoro-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-6-(4-methoxybenzyl)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK817465
SMILES CCCOc1ccc(cc1F)c1nn(cc1/C=c/1\sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)OC)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 C32H26FN5O4S MW 595.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H26FN5O4S/c1-3-15-42-27-14-11-21(17-25(27)33)29-22(19-37(36-29)23-7-5-4-6-8-23)18-28-31(40)38-32(43-28)34-30(39)26(35-38)16-20-9-12-24(41-2)13-10-20/h4-14,17-19H,3,15-16H2,1-2H3/b28-18-
InChIKey
WKKHHWIJPKCUOY-VEILYXNESA-N
Synonyms
956783-65-6
(2Z)2((3(3fluoro4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)6(4methoxybenzyl)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(2Z)2((3(3FLUORO4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)6((4METHOXYPHENYL)METHYL)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(Z)2((3(3fluoro4propoxyphenyl)1phenyl1Hpyrazol4yl)methylene)6(4methoxybenzyl)2Hthiazolo(32b)(124)triazine37dione
956783656
CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=O)C(=N4)CC5=CC=C(C=C5)OC)S3)C6=CC=CC=C6)F
CCCOc1ccc(cc1F)c1nn(cc1C=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)OC)c1ccccc1
InChI=1SC32H26FN5O4Sc13154227141121(1725(27)33)2922(1937(3629)237546823)182831(40)3832(4328)3430(39)26(3538)162091224(412)131020h4141719H31516H212H3b2818
MFCD05734686
ZINC000097946739
ZINC97946739

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Available files

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