Vitas-M small molecule compound

(5Z)-5-{[3-(3-methyl-4-propoxyphenyl)-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
STK798501
SMILES CCCOc1ccc(cc1C)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccncc1)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 C29H24N6O2S MW 520.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N6O2S/c1-3-15-37-24-10-9-21(16-19(24)2)26-22(18-34(32-26)23-7-5-4-6-8-23)17-25-28(36)35-29(38-25)31-27(33-35)20-11-13-30-14-12-20/h4-14,16-18H,3,15H2,1-2H3/b25-17-
InChIKey
CIAZGWRILUDSLV-UQQQWYQISA-N
Synonyms

(5Z)5((3(3methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2(pyridin4yl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((3(3METHYL4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2PYRIDIN4YL(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((3(3methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylene)2(pyridin4yl)thiazolo(32b)(124)triazol6(5H)one
CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=NC=C5)S3)C6=CC=CC=C6)C
CCCOc1ccc(cc1C)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccncc1)c1ccccc1
InChI=1SC29H24N6O2Sc1315372410921(1619(24)2)2622(1834(3226)237546823)172528(36)3529(3825)3127(3335)20111330141220h4141618H315H212H3b2517
MFCD02991480
ZINC000013801288
ZINC13801288

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Available files

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