Vitas-M small molecule compound
(5Z)-5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK821359
SMILES CCOc1ccc(cc1)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)C)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 C29H23N5O2S MW 505.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N5O2S/c1-3-36-24-15-13-20(14-16-24)26-22(18-33(31-26)23-7-5-4-6-8-23)17-25-28(35)34-29(37-25)30-27(32-34)21-11-9-19(2)10-12-21/h4-18H,3H2,1-2H3/b25-17-InChIKey
CUXLUOPJZYSARC-UQQQWYQISA-NSynonyms
(5Z)5((3(4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2(4methylphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((3(4ETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2(4METHYLPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)C)S3)C6=CC=CC=C6
CCOc1ccc(cc1)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)C)c1ccccc1
InChI=1SC29H23N5O2Sc133624151320(141624)2622(1833(3126)237546823)172528(35)3429(3725)3027(3234)2111919(2)101221h418H3H212H3b2517
MFCD01457951
ZINC000026963967
ZINC26963967
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