Vitas-M small molecule compound
(2E)-6-hydroxy-7-({[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]amino}methyl)-2-(thiophen-2-ylmethylidene)-1-benzofuran-3(2H)-one
Catalog ID
STL484227
SMILES Oc1ccc2c(c1CNC[C@@H]1CCCN3[C@@H]1CCCC3)O/C(=C/c1cccs1)/C2=O
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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 C24H28N2O3S MW 424.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O3S/c27-21-9-8-18-23(28)22(13-17-6-4-12-30-17)29-24(18)19(21)15-25-14-16-5-3-11-26-10-2-1-7-20(16)26/h4,6,8-9,12-13,16,20,25,27H,1-3,5,7,10-11,14-15H2/b22-13+/t16-,20+/m0/s1InChIKey
RNLNHZCNSMLHLC-KSWTUVBBSA-NSynonyms
(2E)6hydroxy7((((1S9aR)octahydro2Hquinolizin1ylmethyl)amino)methyl)2(thiophen2ylmethylidene)1benzofuran3(2H)one
(2E)7((((1S9aR)23467899aoctahydro1Hquinolizin1yl)methylamino)methyl)6hydroxy2(thiophen2ylmethylidene)1benzofuran3one
(E)6hydroxy7(((((1S9aR)octahydro1Hquinolizin1yl)methyl)amino)methyl)2(thiophen2ylmethylene)benzofuran3(2H)onedihydrochloride
C1CCN2CCCC(C2C1)CNCC3=C(C=CC4=C3OC(=CC5=CC=CS5)C4=O)O
InChI=1SC24H28N2O3Sc2721981823(28)22(131764123017)2924(18)19(21)152514165311261021720(16)26h4689121316202527H135710111415H2b2213+t1620+m0s1
Oc1ccc2c(c1CNC(C@@H)1CCCN3(C@@H)1CCCC3)OC(=Cc1cccs1)C2=O
Oc1ccc2c(c1CNC(C@@H)1CCCN3(C@@H)1CCCC3)OC(=Cc1cccs1)C2=OClCl
ZINC000097963069
ZINC97963069
Check stock
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