Vitas-M small molecule compound
N-(3,4-dimethylphenyl)-2-{2-ethoxy-4-[(Z)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetamide
Catalog ID
STL164209
SMILES CCOc1cc(ccc1OCC(=O)Nc1ccc(c(c1)C)C)/C=C\1/C(=NN(C1=O)c1ccccc1)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 C29H29N3O4 MW 483.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O4/c1-5-35-27-17-22(16-25-21(4)31-32(29(25)34)24-9-7-6-8-10-24)12-14-26(27)36-18-28(33)30-23-13-11-19(2)20(3)15-23/h6-17H,5,18H2,1-4H3,(H,30,33)/b25-16-InChIKey
HICWYLQIQASCBY-XYGWBWBKSA-NSynonyms
CCOC1=C(C=CC(=C1)C=C2C(=NN(C2=O)C3=CC=CC=C3)C)OCC(=O)NC4=CC(=C(C=C4)C)C
CCOc1cc(ccc1OCC(=O)Nc1ccc(c(c1)C)C)C=C1C(=NN(C1=O)c1ccccc1)C
InChI=1SC29H29N3O4c1535271722(162521(4)3132(29(25)34)2497681024)121426(27)361828(33)3023131119(2)20(3)1523h617H518H214H3(H3033)b2516
MFCD03160341
N(34dimethylphenyl)2(2ethoxy4((Z)(3methyl5oxo1phenyl15dihydro4Hpyrazol4ylidene)methyl)phenoxy)acetamide
N(34DIMETHYLPHENYL)2(2ETHOXY4((Z)(3METHYL5OXO1PHENYLPYRAZOL4YLIDENE)METHYL)PHENOXY)ACETAMIDE
ZINC000033335228
ZINC33335228
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