Vitas-M small molecule compound
(5Z)-2-(4-bromophenyl)-5-{[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK703202
SMILES CCOc1ccc(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 C29H22BrN5O2S MW 584.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22BrN5O2S/c1-3-37-24-14-11-20(15-18(24)2)26-21(17-34(32-26)23-7-5-4-6-8-23)16-25-28(36)35-29(38-25)31-27(33-35)19-9-12-22(30)13-10-19/h4-17H,3H2,1-2H3/b25-16-InChIKey
GHRVHVCYWSMQSK-XYGWBWBKSA-NSynonyms
(5Z)2(4bromophenyl)5((3(4ethoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(4BROMOPHENYL)5((3(4ETHOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)2(4bromophenyl)5((3(4ethoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)thiazolo(32b)(124)triazol6(5H)one
CCOC1=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
CCOc1ccc(cc1C)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)Br)c1ccccc1
InChI=1SC29H22BrN5O2Sc133724141120(1518(24)2)2621(1734(3226)237546823)162528(36)3529(3825)3127(3335)1991222(30)131019h417H3H212H3b2516
MFCD02989168
ZINC000097999413
ZINC97999413
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