Vitas-M small molecule compound

(5Z)-2-phenyl-5-({1-phenyl-3-[4-(prop-2-en-1-yloxy)phenyl]-1H-pyrazol-4-yl}methylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK703049
SMILES C=CCOc1ccc(cc1)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccccc1)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 C29H21N5O2S MW 503.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21N5O2S/c1-2-17-36-24-15-13-20(14-16-24)26-22(19-33(31-26)23-11-7-4-8-12-23)18-25-28(35)34-29(37-25)30-27(32-34)21-9-5-3-6-10-21/h2-16,18-19H,1,17H2/b25-18-
InChIKey
YQNYWKUCRHLNHP-BWAHOGKJSA-N
Synonyms

(5Z)2phenyl5((1phenyl3(4(prop2en1yloxy)phenyl)1Hpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2PHENYL5((1PHENYL3(4PROP2ENOXYPHENYL)PYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((3(4(allyloxy)phenyl)1phenyl1Hpyrazol4yl)methylene)2phenylthiazolo(32b)(124)triazol6(5H)one
C=CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=CC=C5)S3)C6=CC=CC=C6
C=CCOc1ccc(cc1)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccccc1)c1ccccc1
InChI=1SC29H21N5O2Sc12173624151320(141624)2622(1933(3126)23117481223)182528(35)3429(3725)3027(3234)2195361021h2161819H117H2b2518
MFCD02997706
ZINC000013810332
ZINC13810332

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Available files

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