Vitas-M small molecule compound

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

Catalog ID
STK813688
SMILES CC(COc1ccc(cc1)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccncc1)c1ccccc1)C

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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 C29H24N6O2S MW 520.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N6O2S/c1-19(2)18-37-24-10-8-20(9-11-24)26-22(17-34(32-26)23-6-4-3-5-7-23)16-25-28(36)35-29(38-25)31-27(33-35)21-12-14-30-15-13-21/h3-17,19H,18H2,1-2H3/b25-16-
InChIKey
LSHXDDFDQOSQNA-XYGWBWBKSA-N
Synonyms
624724-07-8
(5Z)5((3(4(2methylpropoxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2(pyridin4yl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((3(4(2METHYLPROPOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2PYRIDIN4YL(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((3(4isobutoxyphenyl)1phenyl1Hpyrazol4yl)methylene)2(pyridin4yl)thiazolo(32b)(124)triazol6(5H)one
5((3(4ISOBUTOXYPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)2(PYRIDIN4YL)THIAZOLO(32B)(124)TRIAZOL6(5H)ONE
624724078
CC(C)COC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=NC=C5)S3)C6=CC=CC=C6
CC(COc1ccc(cc1)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccncc1)c1ccccc1)C
InChI=1SC29H24N6O2Sc119(2)18372410820(91124)2622(1734(3226)236435723)162528(36)3529(3825)3127(3335)21121430151321h31719H18H212H3b2516
MFCD03213456
ZINC000002374669
ZINC02374669
ZINC2374669

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Available files

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