Vitas-M small molecule compound

(2E)-6-benzyl-2-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK876891
SMILES O=c1/c(=C\c2cn(nc2c2cccs2)c2ccccc2)/sc2n1nc(Cc1ccccc1)c(=O)n2

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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 C26H17N5O2S2 MW 495.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17N5O2S2/c32-24-20(14-17-8-3-1-4-9-17)28-31-25(33)22(35-26(31)27-24)15-18-16-30(19-10-5-2-6-11-19)29-23(18)21-12-7-13-34-21/h1-13,15-16H,14H2/b22-15+
InChIKey
BHJZSERIPIEJBC-PXLXIMEGSA-N
Synonyms
384800-82-2
(2E)6benzyl2((1phenyl3(thiophen2yl)1Hpyrazol4yl)methylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(2E)6BENZYL2((1PHENYL3THIOPHEN2YLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(E)6benzyl2((1phenyl3(thiophen2yl)1Hpyrazol4yl)methylene)2Hthiazolo(32b)(124)triazine37dione
2((1PHENYL3(2THIENYL)PYRAZOL4YL)METHYLENE)6BENZYL13THIAZOLIDINO(32B)124TRIAZINE37DIONE
384800822
C1=CC=C(C=C1)CC2=NN3C(=O)C(=CC4=CN(N=C4C5=CC=CS5)C6=CC=CC=C6)SC3=NC2=O
InChI=1SC26H17N5O2S2c322420(14178314917)283125(33)22(3526(31)2724)15181630(19105261119)2923(18)21127133421h1131516H14H2b2215+
MFCD03284258
O=c1c(=Cc2cn(nc2c2cccs2)c2ccccc2)sc2n1nc(Cc1ccccc1)c(=O)n2
ZINC000013551738
ZINC13551738

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Available files

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