Vitas-M small molecule compound

ethyl 2-{[(4-chlorophenyl)acetyl]amino}-5-[(2,4-dimethoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate

Catalog ID
STK097043
SMILES CCOC(=O)c1c(NC(=O)Cc2ccc(cc2)Cl)sc(c1C)C(=O)Nc1ccc(cc1OC)OC

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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 C25H25ClN2O6S MW 517.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN2O6S/c1-5-34-25(31)21-14(2)22(23(30)27-18-11-10-17(32-3)13-19(18)33-4)35-24(21)28-20(29)12-15-6-8-16(26)9-7-15/h6-11,13H,5,12H2,1-4H3,(H,27,30)(H,28,29)
InChIKey
RSEOFHYBWKKNSF-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C=C(C=C2)OC)OC)NC(=O)CC3=CC=C(C=C3)Cl
CCOC(=O)c1c(NC(=O)Cc2ccc(cc2)Cl)sc(c1C)C(=O)Nc1ccc(cc1OC)OC
ETHYL2(((4CHLOROPHENYL)ACETYL)AMINO)5((24DIMETHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2((2(4CHLOROPHENYL)ACETYL)AMINO)5((24DIMETHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5(N(24DIMETHOXYPHENYL)CARBAMOYL)2(2(4CHLOROPHENYL)ACETYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC25H25ClN2O6Sc153425(31)2114(2)22(23(30)2718111017(323)1319(18)334)3524(21)2820(29)12156816(26)9715h61113H512H214H3(H2730)(H2829)
MFCD01874820
STK097043
ZINC000001107168
ZINC01107168
ZINC1107168

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Available files

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