Vitas-M small molecule compound
(5Z)-5-({3-[4-(3-methylbutoxy)phenyl]-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
STK704090
SMILES CCCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1cn(nc1c1ccc(cc1)OCCC(C)C)c1ccccc1)/s2
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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 C34H33N5O3S MW 591.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H33N5O3S/c1-4-19-41-28-16-12-25(13-17-28)32-35-34-39(37-32)33(40)30(43-34)21-26-22-38(27-8-6-5-7-9-27)36-31(26)24-10-14-29(15-11-24)42-20-18-23(2)3/h5-17,21-23H,4,18-20H2,1-3H3/b30-21-InChIKey
XWLIOGZPCZZTBY-OFWBYEQRSA-NSynonyms
(5Z)5((3(4(3methylbutoxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2(4propoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((3(4(3METHYLBUTOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2(4PROPOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
CCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC=C(C=C5)OCCC(C)C)C6=CC=CC=C6)SC3=N2
CCCOc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1cn(nc1c1ccc(cc1)OCCC(C)C)c1ccccc1)s2
InChI=1SC34H33N5O3Sc14194128161225(131728)32353439(3732)33(40)30(4334)21262238(278657927)3631(26)24101429(151124)42201823(2)3h5172123H41820H213H3b3021
MFCD03534418
ZINC000097946602
ZINC97946602
Check stock
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Check stock on Vitas-MAvailable files
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