Vitas-M small molecule compound

methyl 2-{[(3,5-dimethylpiperidin-1-yl)acetyl]amino}-4-(4-fluorophenyl)thiophene-3-carboxylate

Catalog ID
STK458977
SMILES COC(=O)c1c(scc1c1ccc(cc1)F)NC(=O)CN1CC(C)CC(C1)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 C21H25FN2O3S MW 404.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25FN2O3S/c1-13-8-14(2)10-24(9-13)11-18(25)23-20-19(21(26)27-3)17(12-28-20)15-4-6-16(22)7-5-15/h4-7,12-14H,8-11H2,1-3H3,(H,23,25)
InChIKey
SEYBEKYVDQHVJC-UHFFFAOYSA-N
Synonyms

CC1CC(CN(C1)CC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)F)C(=O)OC)C
InChI=1SC21H25FN2O3Sc113814(2)1024(913)1118(25)232019(21(26)273)17(122820)154616(22)7515h471214H811H213H3(H2325)
methyl2(((35dimethylpiperidin1yl)acetyl)amino)4(4fluorophenyl)thiophene3carboxylate
methyl2((2(35dimethylpiperidin1yl)acetyl)amino)4(4fluorophenyl)thiophene3carboxylate
METHYL2(2(35DIMETHYLPIPERIDYL)ACETYLAMINO)4(4FLUOROPHENYL)THIOPHENE3CARBOXYLATE
MFCD06195102
ZINC000017082888
ZINC000017082890

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.