Vitas-M small molecule compound

methyl (5E)-1-(4-fluorophenyl)-2-methyl-5-[(3-methylthiophen-2-yl)methylidene]-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK169259
SMILES COC(=O)C1=C(C)N(/C(=C/c2sccc2C)/C1=O)c1ccc(cc1)F

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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 C19H16FNO3S MW 357.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16FNO3S/c1-11-8-9-25-16(11)10-15-18(22)17(19(23)24-3)12(2)21(15)14-6-4-13(20)5-7-14/h4-10H,1-3H3/b15-10+
InChIKey
ACXHEIMPLYKPMJ-XNTDXEJSSA-N
Synonyms

CC1=C(SC=C1)C=C2C(=O)C(=C(N2C3=CC=C(C=C3)F)C)C(=O)OC
COC(=O)C1=C(C)N(C(=Cc2sccc2C)C1=O)c1ccc(cc1)F
InChI=1SC19H16FNO3Sc111892516(11)101518(22)17(19(23)243)12(2)21(15)146413(20)5714h410H13H3b1510+
METHYL(5E)1(4FLUOROPHENYL)2METHYL5((3METHYLTHIOPHEN2YL)METHYLIDENE)4OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(5E)1(4FLUOROPHENYL)2METHYL5((3METHYLTHIOPHEN2YL)METHYLIDENE)4OXOPYRROLE3CARBOXYLATE
MFCD08675161
ZINC000004703153
ZINC04703153
ZINC4703153

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Available files

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