Vitas-M small molecule compound
(4E)-4-(3-chloro-5-ethoxy-4-methoxybenzylidene)-2-(4-chlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK958191
SMILES CCOc1cc(/C=C/2\C(=NN(C2=O)c2ccc(cc2)Cl)C)cc(c1OC)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 C20H18Cl2N2O3 MW 405.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18Cl2N2O3/c1-4-27-18-11-13(10-17(22)19(18)26-3)9-16-12(2)23-24(20(16)25)15-7-5-14(21)6-8-15/h5-11H,4H2,1-3H3/b16-9+InChIKey
GPAUANCOFKYOBM-CXUHLZMHSA-NSynonyms
(4E)4((3CHLORO5ETHOXY4METHOXYPHENYL)METHYLIDENE)2(4CHLOROPHENYL)5METHYLPYRAZOL3ONE
(4E)4(3chloro5ethoxy4methoxybenzylidene)2(4chlorophenyl)5methyl24dihydro3Hpyrazol3one
4(3CHLORO5ETHOXY4METHOXYBENZYLIDENE)2(4CHLOROPHENYL)5METHYL24DIHYDRO3HPYRAZOL3ONE
CCOC1=C(C(=CC(=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)Cl)C)Cl)OC
CCOc1cc(C=C2C(=NN(C2=O)c2ccc(cc2)Cl)C)cc(c1OC)Cl
InChI=1SC20H18Cl2N2O3c1427181113(1017(22)19(18)263)91612(2)2324(20(16)25)157514(21)6815h511H4H213H3b169+
MFCD01835243
ZINC000000670521
ZINC00670521
ZINC670521
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