Vitas-M small molecule compound
2-{5-(3,4-dimethoxyphenyl)-1-[(2E)-3-phenylprop-2-enoyl]-4,5-dihydro-1H-pyrazol-3-yl}phenyl acetate
Catalog ID
STL016628
SMILES COc1ccc(cc1OC)C1CC(=NN1C(=O)/C=C/c1ccccc1)c1ccccc1OC(=O)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 C28H26N2O5 MW 470.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O5/c1-19(31)35-25-12-8-7-11-22(25)23-18-24(21-14-15-26(33-2)27(17-21)34-3)30(29-23)28(32)16-13-20-9-5-4-6-10-20/h4-17,24H,18H2,1-3H3/b16-13+InChIKey
QVPOSFBYDCCCMR-DTQAZKPQSA-NSynonyms
1164461-98-6(2(3(34DIMETHOXYPHENYL)2((E)3PHENYLPROP2ENOYL)34DIHYDROPYRAZOL5YL)PHENYL)ACETATE
(E)2(1cinnamoyl5(34dimethoxyphenyl)45dihydro1Hpyrazol3yl)phenylacetate
1164461986
2(5(34dimethoxyphenyl)1((2E)3phenylprop2enoyl)45dihydro1Hpyrazol3yl)phenylacetate
ACETICACID2(5(34DIMETHOXYPHENYL)1((E)(3PHENYLACRYLOYL))45DIHYDRO1HPYRAZOL3YL)PHENYLESTER
CC(=O)OC1=CC=CC=C1C2=NN(C(C2)C3=CC(=C(C=C3)OC)OC)C(=O)C=CC4=CC=CC=C4
COc1ccc(cc1OC)C1CC(=NN1C(=O)C=Cc1ccccc1)c1ccccc1OC(=O)C
InChI=1SC28H26N2O5c119(31)352512871122(25)231824(21141526(332)27(1721)343)30(2923)28(32)16132095461020h41724H18H213H3b1613+
MFCD04159594
ZINC000008684628
ZINC000008684629
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