Vitas-M small molecule compound

methyl 2-({[2-(3,4-dimethylphenyl)quinolin-4-yl]carbonyl}amino)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate

Catalog ID
STK424057
SMILES COC(=O)c1c(sc(c1c1ccc(cc1)F)C)NC(=O)c1cc(nc2c1cccc2)c1ccc(c(c1)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 C31H25FN2O3S MW 524.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25FN2O3S/c1-17-9-10-21(15-18(17)2)26-16-24(23-7-5-6-8-25(23)33-26)29(35)34-30-28(31(36)37-4)27(19(3)38-30)20-11-13-22(32)14-12-20/h5-16H,1-4H3,(H,34,35)
InChIKey
VSUHBWSLVXNVEB-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)C5=CC=C(C=C5)F)C(=O)OC)C
InChI=1SC31H25FN2O3Sc11791021(1518(17)2)261624(23756825(23)3326)29(35)343028(31(36)374)27(19(3)3830)20111322(32)141220h516H14H3(H3435)
methyl2(((2(34dimethylphenyl)quinolin4yl)carbonyl)amino)4(4fluorophenyl)5methylthiophene3carboxylate
METHYL2((2(34DIMETHYLPHENYL)(4QUINOLYL))CARBONYLAMINO)4(4FLUOROPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
METHYL2((2(34DIMETHYLPHENYL)QUINOLINE4CARBONYL)AMINO)4(4FLUOROPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
MFCD02176694
ZINC000002759522
ZINC02759522
ZINC2759522

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Available files

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