Vitas-M small molecule compound

ethyl 2-[({6-bromo-2-[4-(propan-2-yl)phenyl]quinolin-4-yl}carbonyl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate

Catalog ID
STK425391
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)C)NC(=O)c1cc(nc2c1cc(Br)cc2)c1ccc(cc1)C(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 C33H29BrN2O3S MW 613.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29BrN2O3S/c1-5-39-33(38)30-27(22-8-6-20(4)7-9-22)18-40-32(30)36-31(37)26-17-29(23-12-10-21(11-13-23)19(2)3)35-28-15-14-24(34)16-25(26)28/h6-19H,5H2,1-4H3,(H,36,37)
InChIKey
GXBIHIVWCGFLRX-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=C(C=C5)C(C)C
ETHYL2(((6BROMO2(4(1METHYLETHYL)PHENYL)QUINOLIN4YL)CARBONYL)AMINO)4(4METHYLPHENYL)THIOPHENE3CARBOXYLATE
ethyl2(((6bromo2(4(propan2yl)phenyl)quinolin4yl)carbonyl)amino)4(4methylphenyl)thiophene3carboxylate
ETHYL2(((6BROMO2(4ISOPROPYLPHENYL)4QUINOLINYL)CARBONYL)AMINO)4(4METHYLPHENYL)3THIOPHENECARBOXYLATE
ETHYL2((6BROMO2(4(METHYLETHYL)PHENYL)(4QUINOLYL))CARBONYLAMINO)4(4METHYLPHENYL)THIOPHENE3CARBOXYLATE
ETHYL2((6BROMO2(4PROPAN2YLPHENYL)QUINOLINE4CARBONYL)AMINO)4(4METHYLPHENYL)THIOPHENE3CARBOXYLATE
InChI=1SC33H29BrN2O3Sc153933(38)3027(228620(4)7922)184032(30)3631(37)261729(23121021(111323)19(2)3)3528151424(34)1625(26)28h619H5H214H3(H3637)
MFCD02374962
ZINC000008454565
ZINC08454565
ZINC8454565

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Available files

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