Vitas-M small molecule compound
ethyl 4-(3-{(1Z)-2-cyano-3-[(4-fluorophenyl)amino]-3-oxoprop-1-en-1-yl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
Catalog ID
STK182488
SMILES CCOC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=C(\C(=O)Nc1ccc(cc1)F)/C#N
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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 C25H22FN3O3 MW 431.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FN3O3/c1-4-32-25(31)18-5-11-23(12-6-18)29-16(2)13-19(17(29)3)14-20(15-27)24(30)28-22-9-7-21(26)8-10-22/h5-14H,4H2,1-3H3,(H,28,30)/b20-14-InChIKey
SXEJNOHGDMIHIF-ZHZULCJRSA-NSynonyms
(Z)ethyl4(3(2cyano3((4fluorophenyl)amino)3oxoprop1en1yl)25dimethyl1Hpyrrol1yl)benzoate
CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)C=C(C#N)C(=O)NC3=CC=C(C=C3)F)C
CCOC(=O)c1ccc(cc1)n1c(C)cc(c1C)C=C(C(=O)Nc1ccc(cc1)F)C#N
ETHYL4(3((1Z)2CYANO3((4FLUOROPHENYL)AMINO)3OXOPROP1EN1YL)25DIMETHYL1HPYRROL1YL)BENZOATE
ETHYL4(3((Z)2CYANO3(4FLUOROANILINO)3OXOPROP1ENYL)25DIMETHYLPYRROL1YL)BENZOATE
InChI=1SC25H22FN3O3c143225(31)1851123(12618)2916(2)1319(17(29)3)1420(1527)24(30)28229721(26)81022h514H4H213H3(H2830)b2014
MFCD02194299
ZINC000002285043
ZINC02285043
ZINC2285043
Check stock
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