Vitas-M small molecule compound

methyl 4-(3,4-dimethylphenyl)-2-[(phenoxyacetyl)amino]thiophene-3-carboxylate

Catalog ID
STK419920
SMILES COC(=O)c1c(scc1c1ccc(c(c1)C)C)NC(=O)COc1ccccc1

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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 C22H21NO4S MW 395.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO4S/c1-14-9-10-16(11-15(14)2)18-13-28-21(20(18)22(25)26-3)23-19(24)12-27-17-7-5-4-6-8-17/h4-11,13H,12H2,1-3H3,(H,23,24)
InChIKey
TVWCHNJPMIYANN-UHFFFAOYSA-N
Synonyms
445001-55-8
445001558
CC1=C(C=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)COC3=CC=CC=C3)C
InChI=1SC22H21NO4Sc11491016(1115(14)2)18132821(20(18)22(25)263)2319(24)1227177546817h41113H12H213H3(H2324)
METHYL4(34DIMETHYLPHENYL)2((2PHENOXYACETYL)AMINO)THIOPHENE3CARBOXYLATE
methyl4(34dimethylphenyl)2((phenoxyacetyl)amino)thiophene3carboxylate
MFCD02373017
ZINC000000668777
ZINC00668777
ZINC668777

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Available files

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