Vitas-M small molecule compound

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

Catalog ID
STK449551
SMILES COC(=O)c1c(scc1c1ccncc1)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 C30H24BrN3O3S MW 586.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24BrN3O3S/c1-17(2)18-4-6-20(7-5-18)26-15-23(22-14-21(31)8-9-25(22)33-26)28(35)34-29-27(30(36)37-3)24(16-38-29)19-10-12-32-13-11-19/h4-17H,1-3H3,(H,34,35)
InChIKey
GFWFUOMQFTUZIA-UHFFFAOYSA-N
Synonyms

CC(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=NC=C5)C(=O)OC
InChI=1SC30H24BrN3O3Sc117(2)184620(7518)261523(221421(31)8925(22)3326)28(35)342927(30(36)373)24(163829)19101232131119h417H13H3(H3435)
methyl2(((6bromo2(4(propan2yl)phenyl)quinolin4yl)carbonyl)amino)4(pyridin4yl)thiophene3carboxylate
METHYL2((6BROMO2(4(METHYLETHYL)PHENYL)(4QUINOLYL))CARBONYLAMINO)4(4PYRIDYL)THIOPHENE3CARBOXYLATE
METHYL2((6BROMO2(4PROPAN2YLPHENYL)QUINOLINE4CARBONYL)AMINO)4PYRIDIN4YLTHIOPHENE3CARBOXYLATE
MFCD03467914
ZINC000002806071
ZINC2806071

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Available files

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