Vitas-M small molecule compound
(5Z)-2-(4-methoxyphenyl)-5-{[3-(2-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK813034
SMILES CCCOc1ccc(c(c1)C)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)OC)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 C31H27N5O3S MW 549.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N5O3S/c1-4-16-39-25-14-15-26(20(2)17-25)28-22(19-35(33-28)23-8-6-5-7-9-23)18-27-30(37)36-31(40-27)32-29(34-36)21-10-12-24(38-3)13-11-21/h5-15,17-19H,4,16H2,1-3H3/b27-18-InChIKey
LVVIUEFDBLFARZ-IMRQLAEWSA-NSynonyms
623935-16-0(5Z)2(4methoxyphenyl)5((3(2methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(4METHOXYPHENYL)5((3(2METHYL4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
2(4METHOXYPHENYL)5((3(2METHYL4PROPOXYPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)THIAZOLO(32B)(124)TRIAZOL6(5H)ONE
623935160
CCCOC1=CC(=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)OC)S3)C6=CC=CC=C6)C
CCCOc1ccc(c(c1)C)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)OC)c1ccccc1
InChI=1SC31H27N5O3Sc14163925141526(20(2)1725)2822(1935(3328)238657923)182730(37)3631(4027)3229(3436)21101224(383)131121h5151719H416H213H3b2718
MFCD03534605
ZINC000002508960
ZINC2508960
Check stock
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Check stock on Vitas-MAvailable files
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