Vitas-M small molecule compound
methyl 2-({[2-(1,3-benzodioxol-5-yl)quinolin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK433596
SMILES COC(=O)c1c(sc2c1CCCC2)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/c1-32-27(31)24-17-7-3-5-9-23(17)35-26(24)29-25(30)18-13-20(28-19-8-4-2-6-16(18)19)15-10-11-21-22(12-15)34-14-33-21/h2,4,6,8,10-13H,3,5,7,9,14H2,1H3,(H,29,30)InChIKey
MOPGPOBUGFBBFJ-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC6=C(C=C5)OCO6
InChI=1SC27H22N2O5Sc13227(31)2417735923(17)3526(24)2925(30)181320(2819842616(18)19)1510112122(1215)34143321h24681013H357914H21H3(H2930)
methyl2(((2(13benzodioxol5yl)quinolin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2(13benzodioxol5yl)quinoline4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD03396721
ZINC000008720921
ZINC08720921
ZINC8720921
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