Vitas-M small molecule compound

(4Z)-4-{1-[(2,3-dimethoxyphenyl)amino]ethylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK231930
SMILES COc1c(cccc1OC)N/C(=C\1/C(=NN(C1=O)c1ccccc1)C)/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 C20H21N3O3 MW 351.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3/c1-13(21-16-11-8-12-17(25-3)19(16)26-4)18-14(2)22-23(20(18)24)15-9-6-5-7-10-15/h5-12,21H,1-4H3/b18-13-
InChIKey
HSOKWGDTKWUTOF-AQTBWJFISA-N
Synonyms

(4Z)4(1((23dimethoxyphenyl)amino)ethylidene)5methyl2phenyl24dihydro3Hpyrazol3one
(4Z)4(1(23DIMETHOXYANILINO)ETHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
4(((23DIMETHOXYPHENYL)AMINO)ETHYLIDENE)3METHYL1PHENYL12DIAZOLIN5ONE
CC1=NN(C(=O)C1=C(C)NC2=C(C(=CC=C2)OC)OC)C3=CC=CC=C3
COc1c(cccc1OC)NC(=C1C(=NN(C1=O)c1ccccc1)C)C
InChI=1SC20H21N3O3c113(21161181217(253)19(16)264)1814(2)2223(20(18)24)1596571015h51221H14H3b1813
MFCD07792715
ZINC000100423138
ZINC100423138

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Available files

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