Vitas-M small molecule compound
methyl (4Z)-1-(3,4-dimethoxyphenyl)-4-(4-fluorobenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK161455
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)F)c1ccc(c(c1)OC)OC
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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 C22H20FNO5 MW 397.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20FNO5/c1-13-20(22(26)29-4)17(11-14-5-7-15(23)8-6-14)21(25)24(13)16-9-10-18(27-2)19(12-16)28-3/h5-12H,1-4H3/b17-11-InChIKey
TWVQEFDGHAKXHB-BOPFTXTBSA-NSynonyms
CC1=C(C(=CC2=CC=C(C=C2)F)C(=O)N1C3=CC(=C(C=C3)OC)OC)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)F)c1ccc(c(c1)OC)OC
InChI=1SC22H20FNO5c11320(22(26)294)17(11145715(23)8614)21(25)24(13)1691018(272)19(1216)283h512H14H3b1711
METHYL(4Z)1(34DIMETHOXYPHENYL)4((4FLUOROPHENYL)METHYLIDENE)2METHYL5OXOPYRROLE3CARBOXYLATE
METHYL(4Z)1(34DIMETHOXYPHENYL)4(4FLUOROBENZYLIDENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03254391
ZINC000004699102
ZINC04699102
ZINC4699102
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