Vitas-M small molecule compound

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

Catalog ID
STK423672
SMILES CCOc1cccc(c1)c1nc2ccccc2c(c1)C(=O)Nc1sc(c(c1C(=O)OC)c1ccc(cc1)OC)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 C32H28N2O5S MW 552.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28N2O5S/c1-5-39-23-10-8-9-21(17-23)27-18-25(24-11-6-7-12-26(24)33-27)30(35)34-31-29(32(36)38-4)28(19(2)40-31)20-13-15-22(37-3)16-14-20/h6-18H,5H2,1-4H3,(H,34,35)
InChIKey
UIBYNDVYGYCLNM-UHFFFAOYSA-N
Synonyms

CCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)C5=CC=C(C=C5)OC)C(=O)OC
InChI=1SC32H28N2O5Sc153923108921(1723)271825(2411671226(24)3327)30(35)343129(32(36)384)28(19(2)4031)20131522(373)161420h618H5H214H3(H3435)
methyl2(((2(3ethoxyphenyl)quinolin4yl)carbonyl)amino)4(4methoxyphenyl)5methylthiophene3carboxylate
METHYL2((2(3ETHOXYPHENYL)(4QUINOLYL))CARBONYLAMINO)4(4METHOXYPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
methyl2((2(3ethoxyphenyl)quinoline4carbonyl)amino)4(4methoxyphenyl)5methylthiophene3carboxylate
MFCD02176888
ZINC000002759707
ZINC2759707

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Available files

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