Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(3-chlorophenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402757
SMILES Clc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1cccs1)C(=O)OCC1CCCO1
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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 C26H26ClNO4S MW 484.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClNO4S/c1-15-23(26(30)32-14-19-7-3-9-31-19)24(16-5-2-6-18(27)11-16)25-20(28-15)12-17(13-21(25)29)22-8-4-10-33-22/h2,4-6,8,10-11,17,19,24,28H,3,7,9,12-14H2,1H3InChIKey
AJDIJQYZAPMCFC-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=CC(=CC=C4)Cl)C(=O)OCC5CCCO5
InChI=1SC26H26ClNO4Sc11523(26(30)3214197393119)24(1652618(27)1116)2520(2815)1217(1321(25)29)2284103322h2468101117192428H3791214H21H3
MFCD02868460
oxolan2ylmethyl4(3chlorophenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
tetrahydrofuran2ylmethyl4(3chlorophenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
ZINC000019955258
ZINC000035830473
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