Vitas-M small molecule compound
(4E)-2-(4-bromophenyl)-4-{[(6-chloro-1,3-benzothiazol-2-yl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL295726
SMILES Brc1ccc(cc1)N1N=C(/C(=C\Nc2nc3c(s2)cc(cc3)Cl)/C1=O)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 C18H12BrClN4OS MW 447.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12BrClN4OS/c1-10-14(17(25)24(23-10)13-5-2-11(19)3-6-13)9-21-18-22-15-7-4-12(20)8-16(15)26-18/h2-9H,1H3,(H,21,22)/b14-9+InChIKey
YBIMEKZKOUXMSD-NTEUORMPSA-NSynonyms
(4E)2(4bromophenyl)4(((6chloro13benzothiazol2yl)amino)methylidene)5methyl24dihydro3Hpyrazol3one
(4E)2(4bromophenyl)4(((6chloro13benzothiazol2yl)amino)methylidene)5methylpyrazol3one
Brc1ccc(cc1)N1N=C(C(=CNc2nc3c(s2)cc(cc3)Cl)C1=O)C
CC1=NN(C(=O)C1=CNC2=NC3=C(S2)C=C(C=C3)Cl)C4=CC=C(C=C4)Br
InChI=1SC18H12BrClN4OSc11014(17(25)24(2310)135211(19)3613)9211822157412(20)816(15)2618h29H1H3(H2122)b149+
MFCD28033104
ZINC000101122260
ZINC101122260
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