Vitas-M small molecule compound
(5Z)-5-{[3-(4-methoxy-2-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(2-methoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK800724
SMILES COc1ccc(c(c1)C)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccccc1OC)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 C29H23N5O3S MW 521.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N5O3S/c1-18-15-21(36-2)13-14-22(18)26-19(17-33(31-26)20-9-5-4-6-10-20)16-25-28(35)34-29(38-25)30-27(32-34)23-11-7-8-12-24(23)37-3/h4-17H,1-3H3/b25-16-InChIKey
FPTRTFJEZHKPAZ-XYGWBWBKSA-NSynonyms
(5Z)5((3(4methoxy2methylphenyl)1phenyl1Hpyrazol4yl)methylidene)2(2methoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((3(4METHOXY2METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2(2METHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
CC1=C(C=CC(=C1)OC)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=CC=C5OC)S3)C6=CC=CC=C6
COc1ccc(c(c1)C)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccccc1OC)c1ccccc1
InChI=1SC29H23N5O3Sc1181521(362)131422(18)2619(1733(3126)2095461020)162528(35)3429(3825)3027(3234)2311781224(23)373h417H13H3b2516
MFCD06285281
ZINC000016735906
ZINC16735906
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