Vitas-M small molecule compound

methyl 2-({[2-(4-tert-butylphenyl)quinolin-4-yl]carbonyl}amino)-4-(4-fluorophenyl)thiophene-3-carboxylate

Catalog ID
STK424076
SMILES COC(=O)c1c(scc1c1ccc(cc1)F)NC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)C(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 C32H27FN2O3S MW 538.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H27FN2O3S/c1-32(2,3)21-13-9-20(10-14-21)27-17-24(23-7-5-6-8-26(23)34-27)29(36)35-30-28(31(37)38-4)25(18-39-30)19-11-15-22(33)16-12-19/h5-18H,1-4H3,(H,35,36)
InChIKey
ZCPSMCNLUAUQBA-UHFFFAOYSA-N
Synonyms

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=C(C=C5)F)C(=O)OC
InChI=1SC32H27FN2O3Sc132(23)2113920(101421)271724(23756826(23)3427)29(36)353028(31(37)384)25(183930)19111522(33)161219h518H14H3(H3536)
METHYL2(((2(4TERTBUTYLPHENYL)4QUINOLINYL)CARBONYL)AMINO)4(4FLUOROPHENYL)3THIOPHENECARBOXYLATE
methyl2(((2(4tertbutylphenyl)quinolin4yl)carbonyl)amino)4(4fluorophenyl)thiophene3carboxylate
METHYL2((2(4(TERTBUTYL)PHENYL)(4QUINOLYL))CARBONYLAMINO)4(4FLUOROPHENYL)THIOPHENE3CARBOXYLATE
METHYL2((2(4TERTBUTYLPHENYL)QUINOLINE4CARBONYL)AMINO)4(4FLUOROPHENYL)THIOPHENE3CARBOXYLATE
MFCD02176400
ZINC000002759157
ZINC02759157
ZINC2759157

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Available files

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