Vitas-M small molecule compound
butan-2-yl 7-(4-chlorophenyl)-2-methyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK080675
SMILES CCC(OC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CC(C2)c1ccc(cc1)Cl)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 C30H34ClNO6 MW 540.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34ClNO6/c1-7-16(2)38-30(34)26-17(3)32-22-12-19(18-8-10-21(31)11-9-18)13-23(33)28(22)27(26)20-14-24(35-4)29(37-6)25(15-20)36-5/h8-11,14-16,19,27,32H,7,12-13H2,1-6H3InChIKey
IUOPGSNWOXYEAG-UHFFFAOYSA-NSynonyms
butan2yl7(4chlorophenyl)2methyl5oxo4(345trimethoxyphenyl)145678hexahydroquinoline3carboxylate
butan2yl7(4chlorophenyl)2methyl5oxo4(345trimethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
CCC(C)OC(=O)C1=C(NC2=C(C1C3=CC(=C(C(=C3)OC)OC)OC)C(=O)CC(C2)C4=CC=C(C=C4)Cl)C
CCC(OC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CC(C2)c1ccc(cc1)Cl)C
InChI=1SC30H34ClNO6c1716(2)3830(34)2617(3)32221219(1881021(31)11918)1323(33)28(22)27(26)201424(354)29(376)25(1520)365h8111416192732H71213H216H3
MFCD01445756
STK080675
ZINC000001082024
ZINC000239119540
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