Vitas-M small molecule compound
2-(propan-2-yloxy)ethyl 4-(3-chlorophenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403014
SMILES CC(OCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)Cl)C(=O)CC(C2)c1cccs1)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 C26H28ClNO4S MW 486.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28ClNO4S/c1-15(2)31-9-10-32-26(30)23-16(3)28-20-13-18(22-8-5-11-33-22)14-21(29)25(20)24(23)17-6-4-7-19(27)12-17/h4-8,11-12,15,18,24,28H,9-10,13-14H2,1-3H3InChIKey
ORLQMGMNKYAJBA-UHFFFAOYSA-NSynonyms
2(propan2yloxy)ethyl4(3chlorophenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
2propan2yloxyethyl4(3chlorophenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=CC(=CC=C4)Cl)C(=O)OCCOC(C)C
InChI=1SC26H28ClNO4Sc115(2)319103226(30)2316(3)28201318(2285113322)1421(29)25(20)24(23)1764719(27)1217h48111215182428H9101314H213H3
MFCD03371028
ZINC000002765333
ZINC000002765336
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