Vitas-M small molecule compound

ethyl 2-({[2-(1,3-benzodioxol-5-yl)quinolin-4-yl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Catalog ID
STK420871
SMILES CCOC(=O)c1c(sc2c1CCC2)NC(=O)c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2

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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 C27H22N2O5S MW 486.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O5S/c1-2-32-27(31)24-17-7-5-9-23(17)35-26(24)29-25(30)18-13-20(28-19-8-4-3-6-16(18)19)15-10-11-21-22(12-15)34-14-33-21/h3-4,6,8,10-13H,2,5,7,9,14H2,1H3,(H,29,30)
InChIKey
RQJFCJCBAGETRO-UHFFFAOYSA-N
Synonyms
445285-65-4
445285654
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC6=C(C=C5)OCO6
ETHYL2(((2(13BENZODIOXOL5YL)4QUINOLINYL)CARBONYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
ethyl2(((2(13benzodioxol5yl)quinolin4yl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ETHYL2((2(13BENZODIOXOL5YL)QUINOLINE4CARBONYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
InChI=1SC27H22N2O5Sc123227(31)241775923(17)3526(24)2925(30)181320(2819843616(18)19)1510112122(1215)34143321h34681013H257914H21H3(H2930)
MFCD02371733
ZINC000002752679
ZINC02752679
ZINC2752679

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Available files

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