Vitas-M small molecule compound

ethyl 2-({[2-(2,5-dimethoxyphenyl)quinolin-4-yl]carbonyl}amino)-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate

Catalog ID
STK428524
SMILES CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccccc1C)NC(=O)c1cc(nc2c1cccc2)c1cc(OC)ccc1OC

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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 C34H31N3O6S MW 609.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31N3O6S/c1-6-43-34(40)29-20(3)30(32(39)36-25-13-9-7-11-19(25)2)44-33(29)37-31(38)23-18-27(35-26-14-10-8-12-22(23)26)24-17-21(41-4)15-16-28(24)42-5/h7-18H,6H2,1-5H3,(H,36,39)(H,37,38)
InChIKey
LILNYAXBMXQLDP-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2C)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=C(C=CC(=C5)OC)OC
ETHYL2(((2(25DIMETHOXYPHENYL)4QUINOLINYL)CARBONYL)AMINO)4METHYL5(2TOLUIDINOCARBONYL)3THIOPHENECARBOXYLATE
ethyl2(((2(25dimethoxyphenyl)quinolin4yl)carbonyl)amino)4methyl5((2methylphenyl)carbamoyl)thiophene3carboxylate
ETHYL2((2(25DIMETHOXYPHENYL)(4QUINOLYL))CARBONYLAMINO)4METHYL5(N(2METHYLPHENYL)CARBAMOYL)THIOPHENE3CARBOXYLATE
ETHYL2((2(25DIMETHOXYPHENYL)QUINOLINE4CARBONYL)AMINO)4METHYL5((2METHYLPHENYL)CARBAMOYL)THIOPHENE3CARBOXYLATE
InChI=1SC34H31N3O6Sc164334(40)2920(3)30(32(39)362513971119(25)2)4433(29)3731(38)231827(3526141081222(23)26)241721(414)151628(24)425h718H6H215H3(H3639)(H3738)
MFCD02244802
ZINC000008454471
ZINC08454471
ZINC8454471

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Available files

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