Vitas-M small molecule compound
2-chloro-5-{(4Z)-4-[4-(dimethylamino)benzylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoic acid
Catalog ID
STK728429
SMILES CC1=NN(C(=O)/C/1=C\c1ccc(cc1)N(C)C)c1ccc(c(c1)C(=O)O)Cl
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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 C20H18ClN3O3 MW 383.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN3O3/c1-12-16(10-13-4-6-14(7-5-13)23(2)3)19(25)24(22-12)15-8-9-18(21)17(11-15)20(26)27/h4-11H,1-3H3,(H,26,27)/b16-10-InChIKey
QLZKGCFIIUJKMX-YBEGLDIGSA-NSynonyms
(Z)2chloro5(4(4(dimethylamino)benzylidene)3methyl5oxo45dihydro1Hpyrazol1yl)benzoicacid
2chloro5((4Z)4((4(dimethylamino)phenyl)methylidene)3methyl5oxopyrazol1yl)benzoicacid
2CHLORO5((4Z)4((4DIMETHYLAMINOPHENYL)METHYLIDENE)3METHYL5OXOPYRAZOL1YL)BENZOICACID
2chloro5((4Z)4(4(dimethylamino)benzylidene)3methyl5oxo45dihydro1Hpyrazol1yl)benzoicacid
CC1=NN(C(=O)C1=Cc1ccc(cc1)N(C)C)c1ccc(c(c1)C(=O)O)Cl
CC1=NN(C(=O)C1=CC2=CC=C(C=C2)N(C)C)C3=CC(=C(C=C3)Cl)C(=O)O
InChI=1SC20H18ClN3O3c11216(10134614(7513)23(2)3)19(25)24(2212)158918(21)17(1115)20(26)27h411H13H3(H2627)b1610
MFCD01158515
ZINC000012412844
ZINC12412844
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