Vitas-M small molecule compound
3-benzyl 6-methyl 2,7-dimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404471
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(c1cccs1)C(=C(N2)C)C(=O)OCc1ccccc1
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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 C25H25NO5S MW 451.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO5S/c1-14-12-17-21(23(27)19(14)24(28)30-3)22(18-10-7-11-32-18)20(15(2)26-17)25(29)31-13-16-8-5-4-6-9-16/h4-11,14,19,22,26H,12-13H2,1-3H3InChIKey
RALJNBDTLUUGNV-UHFFFAOYSA-NSynonyms
3benzyl6methyl27dimethyl5oxo4(thiophen2yl)145678hexahydroquinoline36dicarboxylate
3Obenzyl6Omethyl27dimethyl5oxo4thiophen2yl4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OCC3=CC=CC=C3)C4=CC=CS4)C(=O)C1C(=O)OC
InChI=1SC25H25NO5Sc114121721(23(27)19(14)24(28)303)22(18107113218)20(15(2)2617)25(29)3113168546916h41114192226H1213H213H3
MFCD04220700
ZINC000001460090
ZINC000195752849
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