Vitas-M small molecule compound
ethyl 4-{(3E)-2,5-dioxo-3-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]pyrrolidin-1-yl}benzoate
Catalog ID
STK622209
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)C/C(=C\c2c(C)nn(c2C)C)/C1=O
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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 C20H21N3O4 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4/c1-5-27-20(26)14-6-8-16(9-7-14)23-18(24)11-15(19(23)25)10-17-12(2)21-22(4)13(17)3/h6-10H,5,11H2,1-4H3/b15-10+InChIKey
BYSMXXNCNZXFJB-XNTDXEJSSA-NSynonyms
956634-00-7(E)ethyl4(25dioxo3((135trimethyl1Hpyrazol4yl)methylene)pyrrolidin1yl)benzoate
956634007
CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(=CC3=C(N(N=C3C)C)C)C2=O
CCOC(=O)c1ccc(cc1)N1C(=O)CC(=Cc2c(C)nn(c2C)C)C1=O
ethyl4((3E)25dioxo3((135trimethyl1Hpyrazol4yl)methylidene)pyrrolidin1yl)benzoate
ethyl4((3E)25dioxo3((135trimethylpyrazol4yl)methylidene)pyrrolidin1yl)benzoate
InChI=1SC20H21N3O4c152720(26)146816(9714)2318(24)1115(19(23)25)101712(2)2122(4)13(17)3h610H511H214H3b1510+
MFCD09794467
ZINC000009575722
ZINC09575722
ZINC9575722
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