Vitas-M small molecule compound
methyl 2-({3-[4-(2-fluorophenyl)piperazin-1-yl]quinoxalin-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL236276
SMILES COC(=O)c1c(Nc2nc3ccccc3nc2N2CCN(CC2)c2ccccc2F)sc2c1CCCC2
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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 C28H28FN5O2S MW 517.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28FN5O2S/c1-36-28(35)24-18-8-2-7-13-23(18)37-27(24)32-25-26(31-21-11-5-4-10-20(21)30-25)34-16-14-33(15-17-34)22-12-6-3-9-19(22)29/h3-6,9-12H,2,7-8,13-17H2,1H3,(H,30,32)InChIKey
YLBUYKQXGKIQFG-UHFFFAOYSA-NSynonyms
385419-91-0385419910
COC(=O)C1=C(SC2=C1CCCC2)NC3=NC4=CC=CC=C4N=C3N5CCN(CC5)C6=CC=CC=C6F
InChI=1SC28H28FN5O2Sc13628(35)24188271323(18)3727(24)322526(312111541020(21)3025)34161433(151734)221263919(22)29h36912H2781317H21H3(H3032)
methyl2((3(4(2fluorophenyl)piperazin1yl)quinoxalin2yl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((3(4(2fluorophenyl)piperazin1yl)quinoxalin2yl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
MFCD03286126
ZINC000002320597
ZINC02320597
ZINC2320597
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