Vitas-M small molecule compound
ethyl (5Z)-5-(4-{2-[(4-fluorophenyl)amino]-2-oxoethoxy}benzylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160846
SMILES CCOC(=O)C1=C(C)N/C(=C\c2ccc(cc2)OCC(=O)Nc2ccc(cc2)F)/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 C23H21FN2O5 MW 424.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21FN2O5/c1-3-30-23(29)21-14(2)25-19(22(21)28)12-15-4-10-18(11-5-15)31-13-20(27)26-17-8-6-16(24)7-9-17/h4-12,25H,3,13H2,1-2H3,(H,26,27)/b19-12-InChIKey
HWZHAWSSRRDLHD-UNOMPAQXSA-NSynonyms
CCOC(=O)C1=C(C)NC(=Cc2ccc(cc2)OCC(=O)Nc2ccc(cc2)F)C1=O
CCOC(=O)C1=C(NC(=CC2=CC=C(C=C2)OCC(=O)NC3=CC=C(C=C3)F)C1=O)C
ETHYL(5Z)5((4(2(4FLUOROANILINO)2OXOETHOXY)PHENYL)METHYLIDENE)2METHYL4OXO1HPYRROLE3CARBOXYLATE
ETHYL(5Z)5(4(2((4FLUOROPHENYL)AMINO)2OXOETHOXY)BENZYLIDENE)2METHYL4OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC23H21FN2O5c133023(29)2114(2)2519(22(21)28)121541018(11515)311320(27)26178616(24)7917h41225H313H212H3(H2627)b1912
MFCD04087196
ZINC000019859097
ZINC19859097
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