Vitas-M small molecule compound
(5Z)-5-{[3-(4-methoxy-3-nitrophenyl)-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
STK821343
SMILES COc1ccc(cc1[N+](=O)[O-])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 C28H20N6O4S MW 536.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20N6O4S/c1-17-8-10-18(11-9-17)26-29-28-33(31-26)27(35)24(39-28)15-20-16-32(21-6-4-3-5-7-21)30-25(20)19-12-13-23(38-2)22(14-19)34(36)37/h3-16H,1-2H3/b24-15-InChIKey
UGIHXRGZALUCOL-IWIPYMOSSA-NSynonyms
(5Z)5((3(4methoxy3nitrophenyl)1phenyl1Hpyrazol4yl)methylidene)2(4methylphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((3(4METHOXY3NITROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2(4METHYLPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
5((3(4METHOXY3NITROPHENYL)1PHENYLPYRAZOL4YL)METHYLENE)2(4METHYLPHENYL)13THIAZOLIDINO(32D)124TRIAZOL6ONE
CC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC(=C(C=C5)OC)(N+)(=O)(O))C6=CC=CC=C6)SC3=N2
COc1ccc(cc1(N+)(=O)(O))c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)C)c1ccccc1
InChI=1SC28H20N6O4Sc11781018(11917)26292833(3126)27(35)24(3928)15201632(216435721)3025(20)19121323(382)22(1419)34(36)37h316H12H3b2415
MFCD03462715
ZINC000100847548
ZINC100847548
Check stock
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Check stock on Vitas-MAvailable files
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