Vitas-M small molecule compound
methyl (4Z)-4-{[1-(2-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5-oxo-1-(tetrahydrofuran-2-ylmethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK161534
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccccc1F)C)CC1CCCO1
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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 C25H27FN2O4 MW 438.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27FN2O4/c1-15-12-18(16(2)28(15)22-10-6-5-9-21(22)26)13-20-23(25(30)31-4)17(3)27(24(20)29)14-19-8-7-11-32-19/h5-6,9-10,12-13,19H,7-8,11,14H2,1-4H3/b20-13-InChIKey
IHHLMAHPYOQRDU-MOSHPQCFSA-NSynonyms
CC1=CC(=C(N1C2=CC=CC=C2F)C)C=C3C(=C(N(C3=O)CC4CCCO4)C)C(=O)OC
InChI=1SC25H27FN2O4c1151218(16(2)28(15)221065921(22)26)132023(25(30)314)17(3)27(24(20)29)141987113219h56910121319H781114H214H3b2013
METHYL(4Z)4((1(2FLUOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)2METHYL5OXO1(TETRAHYDROFURAN2YLMETHYL)45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((1(2FLUOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2METHYL5OXO1(OXOLAN2YLMETHYL)PYRROLE3CARBOXYLATE
METHYL3((1(2FLUOROPHENYL)25DIMETHYLPYRROL3YL)METHYLENE)5METHYL2OXO1(OXOLAN2YLMETHYL)AZOLINE4CARBOXYLATE
MFCD03252157
ZINC000012445299
ZINC000012445301
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