Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(2-chlorophenyl)-7-(4-fluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK406144
SMILES Fc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccccc1Cl)C(=O)OCC1CCCO1)C
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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 C28H27ClFNO4 MW 495.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27ClFNO4/c1-16-25(28(33)35-15-20-5-4-12-34-20)26(21-6-2-3-7-22(21)29)27-23(31-16)13-18(14-24(27)32)17-8-10-19(30)11-9-17/h2-3,6-11,18,20,26,31H,4-5,12-15H2,1H3InChIKey
GDILGTLATOCCCK-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)F)C4=CC=CC=C4Cl)C(=O)OCC5CCCO5
InChI=1SC28H27ClFNO4c11625(28(33)35152054123420)26(21623722(21)29)2723(3116)1318(1424(27)32)1781019(30)11917h2361118202631H451215H21H3
MFCD05986917
oxolan2ylmethyl4(2chlorophenyl)7(4fluorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
tetrahydrofuran2ylmethyl4(2chlorophenyl)7(4fluorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
ZINC000001130155
ZINC000036008085
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