Vitas-M small molecule compound
methyl 4-({(Z)-[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoate
Catalog ID
STK957279
SMILES COC(=O)c1ccc(cc1)N/C=C\1/C(=NN(C1=O)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 C19H16BrN3O3 MW 414.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrN3O3/c1-12-17(11-21-15-7-3-13(4-8-15)19(25)26-2)18(24)23(22-12)16-9-5-14(20)6-10-16/h3-11,21H,1-2H3/b17-11-InChIKey
JGXMVELAPXVYQB-BOPFTXTBSA-NSynonyms
354994-54-0354994540
CC1=NN(C(=O)C1=CNC2=CC=C(C=C2)C(=O)OC)C3=CC=C(C=C3)Br
COC(=O)c1ccc(cc1)NC=C1C(=NN(C1=O)c1ccc(cc1)Br)C
InChI=1SC19H16BrN3O3c11217(1121157313(4815)19(25)262)18(24)23(2212)169514(20)61016h31121H12H3b1711
METHYL4(((1(4BROMOPHENYL)3METHYL5OXO15DIHYDRO4HPYRAZOL4YLIDENE)METHYL)AMINO)BENZOATE
methyl4(((Z)(1(4bromophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)benzoate
METHYL4(((Z)(1(4BROMOPHENYL)3METHYL5OXOPYRAZOL4YLIDENE)METHYL)AMINO)BENZOATE
MFCD01178553
ZINC000005575853
ZINC05575853
ZINC5575853
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