Vitas-M small molecule compound

propan-2-yl 4-carbamoyl-5-{[2-(4-chloro-2-methylphenoxy)propanoyl]amino}-3-methylthiophene-2-carboxylate

Catalog ID
STK418622
SMILES CC(OC(=O)c1sc(c(c1C)C(=O)N)NC(=O)C(Oc1ccc(cc1C)Cl)C)C

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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 C20H23ClN2O5S MW 438.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN2O5S/c1-9(2)27-20(26)16-11(4)15(17(22)24)19(29-16)23-18(25)12(5)28-14-7-6-13(21)8-10(14)3/h6-9,12H,1-5H3,(H2,22,24)(H,23,25)
InChIKey
RHKZYIZRHUGGRC-UHFFFAOYSA-N
Synonyms
353769-05-8
353769058
CC1=C(C=CC(=C1)Cl)OC(C)C(=O)NC2=C(C(=C(S2)C(=O)OC(C)C)C)C(=O)N
InChI=1SC20H23ClN2O5Sc19(2)2720(26)1611(4)15(17(22)24)19(2916)2318(25)12(5)28147613(21)810(14)3h6912H15H3(H22224)(H2325)
ISOPROPYL4(AMINOCARBONYL)5((2(4CHLORO2METHYLPHENOXY)PROPANOYL)AMINO)3METHYL2THIOPHENECARBOXYLATE
MFCD02053774
propan2yl4carbamoyl5((2(4chloro2methylphenoxy)propanoyl)amino)3methylthiophene2carboxylate
PROPAN2YL4CARBAMOYL5(2(4CHLORO2METHYLPHENOXY)PROPANOYLAMINO)3METHYLTHIOPHENE2CARBOXYLATE
ZINC000000669300
ZINC000000669301

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Available files

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