Vitas-M small molecule compound

methyl 2-{[(4-chlorophenyl)acetyl]amino}-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate

Catalog ID
STK421764
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)Cc1ccc(cc1)Cl)CC

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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 C20H23ClN2O4S MW 422.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN2O4S/c1-5-23(6-2)19(25)17-12(3)16(20(26)27-4)18(28-17)22-15(24)11-13-7-9-14(21)10-8-13/h7-10H,5-6,11H2,1-4H3,(H,22,24)
InChIKey
LPUNJLRESKSSIY-UHFFFAOYSA-N
Synonyms
353784-40-4
353784404
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CC2=CC=C(C=C2)Cl)C(=O)OC)C
InChI=1SC20H23ClN2O4Sc1523(62)19(25)1712(3)16(20(26)274)18(2817)2215(24)11137914(21)10813h710H5611H214H3(H2224)
methyl2(((4chlorophenyl)acetyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
METHYL2((2(4CHLOROPHENYL)ACETYL)AMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL2(2(4CHLOROPHENYL)ACETAMIDO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD01336995
ZINC000000994630
ZINC00994630
ZINC994630

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Available files

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