Vitas-M small molecule compound

methyl 2-({[2-(4-chlorophenyl)quinolin-4-yl]carbonyl}amino)-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate

Catalog ID
STK427914
SMILES COC(=O)c1c(NC(=O)c2cc(nc3c2cccc3)c2ccc(cc2)Cl)sc(c1C)C(=O)N(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 C26H22ClN3O4S MW 508.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN3O4S/c1-14-21(26(33)34-4)24(35-22(14)25(32)30(2)3)29-23(31)18-13-20(15-9-11-16(27)12-10-15)28-19-8-6-5-7-17(18)19/h5-13H,1-4H3,(H,29,31)
InChIKey
JUKNMKKBXOJRKT-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl)C(=O)N(C)C
InChI=1SC26H22ClN3O4Sc11421(26(33)344)24(3522(14)25(32)30(2)3)2923(31)181320(1591116(27)121015)2819865717(18)19h513H14H3(H2931)
METHYL2(((2(4CHLOROPHENYL)4QUINOLINYL)CARBONYL)AMINO)5((DIMETHYLAMINO)CARBONYL)4METHYL3THIOPHENECARBOXYLATE
methyl2(((2(4chlorophenyl)quinolin4yl)carbonyl)amino)5(dimethylcarbamoyl)4methylthiophene3carboxylate
METHYL2((2(4CHLOROPHENYL)QUINOLINE4CARBONYL)AMINO)5(DIMETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL5(NNDIMETHYLCARBAMOYL)2((2(4CHLOROPHENYL)(4QUINOLYL))CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD03233398
ZINC000002757159
ZINC02757159
ZINC2757159

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Available files

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