Vitas-M small molecule compound
(5Z)-2-(4-bromophenyl)-5-{[3-(4-butoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK533830
SMILES CCCCOc1ccc(cc1C)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)Br)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 C31H26BrN5O2S MW 612.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26BrN5O2S/c1-3-4-16-39-26-15-12-22(17-20(26)2)28-23(19-36(34-28)25-8-6-5-7-9-25)18-27-30(38)37-31(40-27)33-29(35-37)21-10-13-24(32)14-11-21/h5-15,17-19H,3-4,16H2,1-2H3/b27-18-InChIKey
RPDPXKXPSOSPJB-IMRQLAEWSA-NSynonyms
(5Z)2(4bromophenyl)5((3(4butoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(4BROMOPHENYL)5((3(4BUTOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)2(4bromophenyl)5((3(4butoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)thiazolo(32b)(124)triazol6(5H)one
CCCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)Br)S3)C6=CC=CC=C6)C
CCCCOc1ccc(cc1C)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)Br)c1ccccc1
InChI=1SC31H26BrN5O2Sc134163926151222(1720(26)2)2823(1936(3428)258657925)182730(38)3731(4027)3329(3537)21101324(32)141121h5151719H3416H212H3b2718
MFCD02989941
ZINC000097999399
ZINC97999399
Check stock
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Check stock on Vitas-MAvailable files
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