Vitas-M small molecule compound
(5Z)-5-({3-[4-(benzyloxy)-3-methylphenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK816594
SMILES CCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1cn(nc1c1ccc(c(c1)C)OCc1ccccc1)c1ccccc1)/c2=O
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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 C37H31N5O3S MW 625.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H31N5O3S/c1-3-20-44-31-17-14-27(15-18-31)35-38-37-42(40-35)36(43)33(46-37)22-29-23-41(30-12-8-5-9-13-30)39-34(29)28-16-19-32(25(2)21-28)45-24-26-10-6-4-7-11-26/h4-19,21-23H,3,20,24H2,1-2H3/b33-22-InChIKey
KYBPHFKKFWSZBQ-NVMPUMLXSA-NSynonyms
(5Z)5((3(3METHYL4PHENYLMETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2(4PROPOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5((3(4(benzyloxy)3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)2(4propoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC(=C(C=C5)OCC6=CC=CC=C6)C)C7=CC=CC=C7)SC3=N2
CCCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1cn(nc1c1ccc(c(c1)C)OCc1ccccc1)c1ccccc1)c2=O
InChI=1SC37H31N5O3Sc13204431171427(151831)35383742(4035)36(43)33(4637)22292341(30128591330)3934(29)28161932(25(2)2128)452426106471126h4192123H32024H212H3b3322
MFCD03534805
ZINC000097946658
ZINC97946658
Check stock
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