Vitas-M small molecule compound
diethyl 4-(3-methoxyphenyl)-5-oxo-2-propyl-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK775955
SMILES CCOC(=O)C1C(=O)C2=C(CC1c1cccs1)NC(=C(C2c1cccc(c1)OC)C(=O)OCC)CCC
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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 C29H33NO6S MW 523.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33NO6S/c1-5-10-20-26(29(33)36-7-3)23(17-11-8-12-18(15-17)34-4)25-21(30-20)16-19(22-13-9-14-37-22)24(27(25)31)28(32)35-6-2/h8-9,11-15,19,23-24,30H,5-7,10,16H2,1-4H3InChIKey
FPXVCADOXPZNIF-UHFFFAOYSA-NSynonyms
CCCC1=C(C(C2=C(N1)CC(C(C2=O)C(=O)OCC)C3=CC=CS3)C4=CC(=CC=C4)OC)C(=O)OCC
diethyl4(3methoxyphenyl)5oxo2propyl7(thiophen2yl)145678hexahydroquinoline36dicarboxylate
diethyl4(3methoxyphenyl)5oxo2propyl7thiophen2yl4678tetrahydro1Hquinoline36dicarboxylate
InChI=1SC29H33NO6Sc15102026(29(33)3673)23(171181218(1517)344)2521(3020)1619(22139143722)24(27(25)31)28(32)3562h89111519232430H571016H214H3
MFCD05258185
ZINC000001422759
ZINC000036037402
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