Vitas-M small molecule compound

methyl 2-{[(4-bromophenyl)acetyl]amino}-5-[(4-methoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate

Catalog ID
STK424043
SMILES COc1ccc(cc1)NC(=O)c1sc(c(c1C)C(=O)OC)NC(=O)Cc1ccc(cc1)Br

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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 C23H21BrN2O5S MW 517.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN2O5S/c1-13-19(23(29)31-3)22(26-18(27)12-14-4-6-15(24)7-5-14)32-20(13)21(28)25-16-8-10-17(30-2)11-9-16/h4-11H,12H2,1-3H3,(H,25,28)(H,26,27)
InChIKey
GVCLXKFWRCNSDH-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)CC2=CC=C(C=C2)Br)C(=O)NC3=CC=C(C=C3)OC
InChI=1SC23H21BrN2O5Sc11319(23(29)313)22(2618(27)12144615(24)7514)3220(13)21(28)251681017(302)11916h411H12H213H3(H2528)(H2627)
methyl2(((4bromophenyl)acetyl)amino)5((4methoxyphenyl)carbamoyl)4methylthiophene3carboxylate
METHYL2((2(4BROMOPHENYL)ACETYL)AMINO)5((4METHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL2(2(4BROMOPHENYL)ACETYLAMINO)5(N(4METHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD02176966
ZINC000002767214
ZINC02767214
ZINC2767214

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Available files

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