Vitas-M small molecule compound
methyl (4Z)-4-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5-oxo-1-(1-phenylethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK161539
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccc(cc1)F)C)C(c1ccccc1)C
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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 C28H27FN2O3 MW 458.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27FN2O3/c1-17-15-22(19(3)30(17)24-13-11-23(29)12-14-24)16-25-26(28(33)34-5)20(4)31(27(25)32)18(2)21-9-7-6-8-10-21/h6-16,18H,1-5H3/b25-16-InChIKey
CDJGYNHCRMJCBG-XYGWBWBKSA-NSynonyms
CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C=C3C(=C(N(C3=O)C(C)C4=CC=CC=C4)C)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1cc(n(c1C)c1ccc(cc1)F)C)C(c1ccccc1)C
InChI=1SC28H27FN2O3c1171522(19(3)30(17)24131123(29)121424)162526(28(33)345)20(4)31(27(25)32)18(2)2197681021h61618H15H3b2516
METHYL(4Z)4((1(4FLUOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)2METHYL5OXO1(1PHENYLETHYL)45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((1(4FLUOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2METHYL5OXO1(1PHENYLETHYL)PYRROLE3CARBOXYLATE
MFCD03257711
ZINC000014009591
ZINC000014009594
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