Vitas-M small molecule compound

ethyl 2-{[(3,4-dichlorophenyl)carbonyl]amino}-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate

Catalog ID
STK023985
SMILES CCOC(=O)c1c(NC(=O)c2ccc(c(c2)Cl)Cl)sc(c1C)C(=O)Nc1ccccc1

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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 C22H18Cl2N2O4S MW 477.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18Cl2N2O4S/c1-3-30-22(29)17-12(2)18(20(28)25-14-7-5-4-6-8-14)31-21(17)26-19(27)13-9-10-15(23)16(24)11-13/h4-11H,3H2,1-2H3,(H,25,28)(H,26,27)
InChIKey
CQCCZIQAMQICRR-UHFFFAOYSA-N
Synonyms
6047-26-3
1H3BENZAZEPINE24DICARBOXYLICACID3ETHYL23DIHYDRO5HYDROXY1OXO24DIMETHYLESTER
6047263
CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC(=O)C3=CC(=C(C=C3)Cl)Cl
ETHYL2(((34DICHLOROPHENYL)CARBONYL)AMINO)4METHYL5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
ETHYL2((34DICHLOROBENZOYL)AMINO)4METHYL5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
ETHYL2((34DICHLOROPHENYL)CARBONYLAMINO)4METHYL5(NPHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
InChI=1SC22H18Cl2N2O4Sc133022(29)1712(2)18(20(28)25147546814)3121(17)2619(27)1391015(23)16(24)1113h411H3H212H3(H2528)(H2627)
MFCD01825096
STK023985
ZINC000002757768
ZINC02757768
ZINC2757768

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Available files

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