Vitas-M small molecule compound
(4E)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-{2-[4-chloro-2-(phenylcarbonyl)phenyl]hydrazinylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK037512
SMILES Clc1ccc(c(c1)C(=O)c1ccccc1)N/N=C/1\C(=NN(C1=O)c1scc(n1)c1ccc(cc1)Br)C
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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 C26H17BrClN5O2S MW 578.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17BrClN5O2S/c1-15-23(25(35)33(32-15)26-29-22(14-36-26)16-7-9-18(27)10-8-16)31-30-21-12-11-19(28)13-20(21)24(34)17-5-3-2-4-6-17/h2-14,30H,1H3/b31-23+InChIKey
MILLLYWJWXESAS-UQRQXUALSA-NSynonyms
(4E)2(4(4BROMOPHENYL)13THIAZOL2YL)4(2(4CHLORO2(PHENYLCARBONYL)PHENYL)HYDRAZINYLIDENE)5METHYL24DIHYDRO3HPYRAZOL3ONE
(4E)4((2benzoyl4chlorophenyl)hydrazinylidene)2(4(4bromophenyl)13thiazol2yl)5methylpyrazol3one
CC1=NN(C(=O)C1=NNC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)C4=NC(=CS4)C5=CC=C(C=C5)Br
Clc1ccc(c(c1)C(=O)c1ccccc1)NN=C1C(=NN(C1=O)c1scc(n1)c1ccc(cc1)Br)C
InChI=1SC26H17BrClN5O2Sc11523(25(35)33(3215)262922(143626)167918(27)10816)313021121119(28)1320(21)24(34)175324617h21430H1H3b3123+
MFCD01246783
STK037512
ZINC000100512416
ZINC33353274
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