Vitas-M small molecule compound

methyl 2-{[(2,4-dichlorophenoxy)acetyl]amino}-4-[4-(propan-2-yl)phenyl]thiophene-3-carboxylate

Catalog ID
STK429289
SMILES COC(=O)c1c(scc1c1ccc(cc1)C(C)C)NC(=O)COc1ccc(cc1Cl)Cl

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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 C23H21Cl2NO4S MW 478.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21Cl2NO4S/c1-13(2)14-4-6-15(7-5-14)17-12-31-22(21(17)23(28)29-3)26-20(27)11-30-19-9-8-16(24)10-18(19)25/h4-10,12-13H,11H2,1-3H3,(H,26,27)
InChIKey
AFHFUSSVKBKFHU-UHFFFAOYSA-N
Synonyms

CC(C)C1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)COC3=C(C=C(C=C3)Cl)Cl
InChI=1SC23H21Cl2NO4Sc113(2)144615(7514)17123122(21(17)23(28)293)2620(27)1130199816(24)1018(19)25h4101213H11H213H3(H2627)
methyl2(((24dichlorophenoxy)acetyl)amino)4(4(propan2yl)phenyl)thiophene3carboxylate
METHYL2(((24DICHLOROPHENOXY)ACETYL)AMINO)4(4ISOPROPYLPHENYL)3THIOPHENECARBOXYLATE
METHYL2((2(24DICHLOROPHENOXY)ACETYL)AMINO)4(4PROPAN2YLPHENYL)THIOPHENE3CARBOXYLATE
METHYL2(2(24DICHLOROPHENOXY)ACETYLAMINO)4(4(METHYLETHYL)PHENYL)THIOPHENE3CARBOXYLATE
MFCD02244879
ZINC000002105501
ZINC02105501
ZINC2105501

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Available files

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