Vitas-M small molecule compound
(4Z)-2-(4-bromophenyl)-4-(4-ethoxy-3-methoxybenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL444667
SMILES CCOc1ccc(cc1OC)/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 C20H19BrN2O3 MW 415.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrN2O3/c1-4-26-18-10-5-14(12-19(18)25-3)11-17-13(2)22-23(20(17)24)16-8-6-15(21)7-9-16/h5-12H,4H2,1-3H3/b17-11-InChIKey
ABNVLGIWXKACRW-BOPFTXTBSA-NSynonyms
(4Z)2(4BROMOPHENYL)4((4ETHOXY3METHOXYPHENYL)METHYLIDENE)5METHYLPYRAZOL3ONE
(4Z)2(4bromophenyl)4(4ethoxy3methoxybenzylidene)5methyl24dihydro3Hpyrazol3one
CCOC1=C(C=C(C=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)Br)C)OC
CCOc1ccc(cc1OC)C=C1C(=NN(C1=O)c1ccc(cc1)Br)C
InChI=1SC20H19BrN2O3c14261810514(1219(18)253)111713(2)2223(20(17)24)168615(21)7916h512H4H213H3b1711
MFCD30712716
ZINC000033316048
ZINC33316048
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