Vitas-M small molecule compound

methyl 5-benzyl-2-{[(2,4-dichlorophenyl)carbonyl]amino}-4-methylthiophene-3-carboxylate

Catalog ID
STK061970
SMILES COC(=O)c1c(sc(c1C)Cc1ccccc1)NC(=O)c1ccc(cc1Cl)Cl

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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 C21H17Cl2NO3S MW 434.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17Cl2NO3S/c1-12-17(10-13-6-4-3-5-7-13)28-20(18(12)21(26)27-2)24-19(25)15-9-8-14(22)11-16(15)23/h3-9,11H,10H2,1-2H3,(H,24,25)
InChIKey
DHCHCMGJZYDXJE-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=C(C=C(C=C2)Cl)Cl)CC3=CC=CC=C3
COC(=O)c1c(sc(c1C)Cc1ccccc1)NC(=O)c1ccc(cc1Cl)Cl
InChI=1SC21H17Cl2NO3Sc11217(10136435713)2820(18(12)21(26)272)2419(25)159814(22)1116(15)23h3911H10H212H3(H2425)
METHYL2((24DICHLOROPHENYL)CARBONYLAMINO)4METHYL5BENZYLTHIOPHENE3CARBOXYLATE
METHYL5BENZYL2(((24DICHLOROPHENYL)CARBONYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
METHYL5BENZYL2((24DICHLOROBENZOYL)AMINO)4METHYL3THIOPHENECARBOXYLATE
METHYL5BENZYL2((24DICHLOROBENZOYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD01438740
STK061970
ZINC000002060891
ZINC02060891
ZINC2060891

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Available files

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