Vitas-M small molecule compound
(4Z)-4-{[(6-bromo-1,3-benzothiazol-2-yl)amino]methylidene}-2-(4-chlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL359380
SMILES Clc1ccc(cc1)N1N=C(/C(=C/Nc2nc3c(s2)cc(cc3)Br)/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)13-5-3-12(20)4-6-13)9-21-18-22-15-7-2-11(19)8-16(15)26-18/h2-9H,1H3,(H,21,22)/b14-9-InChIKey
BDVOKYXIWMMIFH-ZROIWOOFSA-NSynonyms
(4Z)4(((6bromo13benzothiazol2yl)amino)methylidene)2(4chlorophenyl)5methyl24dihydro3Hpyrazol3one
(4Z)4(((6bromo13benzothiazol2yl)amino)methylidene)2(4chlorophenyl)5methylpyrazol3one
CC1=NN(C(=O)C1=CNC2=NC3=C(S2)C=C(C=C3)Br)C4=CC=C(C=C4)Cl
Clc1ccc(cc1)N1N=C(C(=CNc2nc3c(s2)cc(cc3)Br)C1=O)C
InChI=1SC18H12BrClN4OSc11014(17(25)24(2310)135312(20)4613)9211822157211(19)816(15)2618h29H1H3(H2122)b149
MFCD28033669
ZINC000101346764
ZINC101346764
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