Vitas-M small molecule compound

methyl 6-tert-butyl-2-({[2-(thiophen-2-yl)quinolin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK418149
SMILES COC(=O)c1c(NC(=O)c2cc(nc3c2cccc3)c2cccs2)sc2c1CCC(C2)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 C28H28N2O3S2 MW 504.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O3S2/c1-28(2,3)16-11-12-18-23(14-16)35-26(24(18)27(32)33-4)30-25(31)19-15-21(22-10-7-13-34-22)29-20-9-6-5-8-17(19)20/h5-10,13,15-16H,11-12,14H2,1-4H3,(H,30,31)
InChIKey
KTGGZFVKWHLXTI-UHFFFAOYSA-N
Synonyms
355000-15-6
355000156
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5
InChI=1SC28H28N2O3S2c128(23)1611121823(1416)3526(24(18)27(32)334)3025(31)191521(22107133422)2920965817(19)20h510131516H111214H214H3(H3031)
methyl6tertbutyl2(((2(thiophen2yl)quinolin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6tertbutyl2((2thiophen2ylquinoline4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD01921146
ZINC000002085932
ZINC000002085933

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Available files

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