Vitas-M small molecule compound
butane-1,4-diyl bis[2-methyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate]
Catalog ID
STK403359
SMILES O=C(C1=C(C)NC2=C(C1c1cccs1)C(=O)CCC2)OCCCCOC(=O)C1=C(C)NC2=C(C1c1cccs1)C(=O)CCC2
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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 C34H36N2O6S2 MW 632.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H36N2O6S2/c1-19-27(31(25-13-7-17-43-25)29-21(35-19)9-5-11-23(29)37)33(39)41-15-3-4-16-42-34(40)28-20(2)36-22-10-6-12-24(38)30(22)32(28)26-14-8-18-44-26/h7-8,13-14,17-18,31-32,35-36H,3-6,9-12,15-16H2,1-2H3InChIKey
VWCCBNBIRBGKOZ-UHFFFAOYSA-NSynonyms
4(2methyl5oxo4thiophen2yl4678tetrahydro1Hquinoline3carbonyl)oxybutyl2methyl5oxo4thiophen2yl4678tetrahydro1Hquinoline3carboxylate
butane14diylbis(2methyl5oxo4(thiophen2yl)145678hexahydroquinoline3carboxylate)
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=CS3)C(=O)OCCCCOC(=O)C4=C(NC5=C(C4C6=CC=CS6)C(=O)CCC5)C
InChI=1SC34H36N2O6S2c11927(31(25137174325)2921(3519)951123(29)37)33(39)411534164234(40)2820(2)36221061224(38)30(22)32(28)26148184426h781314171831323536H369121516H212H3
MFCD03489175
ZINC000097939651
ZINC000097939653
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