Vitas-M small molecule compound
4-[(Z)-(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-methoxyphenyl propanoate
Catalog ID
STL431862
SMILES CCC(=O)Oc1ccc(cc1OC)/C=C\1/C(=O)NN(C1=O)c1ccccc1
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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 C20H18N2O5 MW 366.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5/c1-3-18(23)27-16-10-9-13(12-17(16)26-2)11-15-19(24)21-22(20(15)25)14-7-5-4-6-8-14/h4-12H,3H2,1-2H3,(H,21,24)/b15-11-InChIKey
ONWOTPSZWGMRPP-PTNGSMBKSA-NSynonyms
(4((Z)(35DIOXO1PHENYLPYRAZOLIDIN4YLIDENE)METHYL)2METHOXYPHENYL)PROPANOATE
4((Z)(35dioxo1phenylpyrazolidin4ylidene)methyl)2methoxyphenylpropanoate
CCC(=O)OC1=C(C=C(C=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OC
CCC(=O)Oc1ccc(cc1OC)C=C1C(=O)NN(C1=O)c1ccccc1
InChI=1SC20H18N2O5c1318(23)271610913(1217(16)262)111519(24)2122(20(15)25)147546814h412H3H212H3(H2124)b1511
MFCD01363492
ZINC000015658677
ZINC15658677
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