Vitas-M small molecule compound
(5Z)-2-(4-tert-butylphenyl)-5-{[3-(3-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
STK703060
SMILES CCCOc1ccc(cc1C)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)C(C)(C)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 C34H33N5O2S MW 575.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H33N5O2S/c1-6-18-41-28-17-14-24(19-22(28)2)30-25(21-38(36-30)27-10-8-7-9-11-27)20-29-32(40)39-33(42-29)35-31(37-39)23-12-15-26(16-13-23)34(3,4)5/h7-17,19-21H,6,18H2,1-5H3/b29-20-InChIKey
OGRHFOQRDBGBHE-BRPDVVIDSA-NSynonyms
(5Z)2(4tertbutylphenyl)5((3(3methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(4TERTBUTYLPHENYL)5((3(3METHYL4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)2(4(tertbutyl)phenyl)5((3(3methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylene)thiazolo(32b)(124)triazol6(5H)one
CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)C(C)(C)C)S3)C6=CC=CC=C6)C
CCCOc1ccc(cc1C)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)C(C)(C)C)c1ccccc1
InChI=1SC34H33N5O2Sc16184128171424(1922(28)2)3025(2138(3630)27108791127)202932(40)3933(4229)3531(3739)23121526(161323)34(34)5h7171921H618H215H3b2920
MFCD02993258
ZINC000100838884
ZINC100838884
Check stock
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Check stock on Vitas-MAvailable files
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