Vitas-M small molecule compound
ethyl 2-amino-4-(4-methoxyphenyl)-7,7-dimethyl-1-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK759636
SMILES CCOC(=O)C1=C(N)N(c2cccc(c2)C)C2=C(C1c1ccc(cc1)OC)C(=O)CC(C2)(C)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 C28H32N2O4 MW 460.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2O4/c1-6-34-27(32)25-23(18-10-12-20(33-5)13-11-18)24-21(15-28(3,4)16-22(24)31)30(26(25)29)19-9-7-8-17(2)14-19/h7-14,23H,6,15-16,29H2,1-5H3InChIKey
PWPJGIJFLGFKJP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=C(C1C3=CC=C(C=C3)OC)C(=O)CC(C2)(C)C)C4=CC=CC(=C4)C)N
ethyl2amino4(4methoxyphenyl)77dimethyl1(3methylphenyl)5oxo145678hexahydroquinoline3carboxylate
ETHYL2AMINO4(4METHOXYPHENYL)77DIMETHYL1(3METHYLPHENYL)5OXO68DIHYDRO4HQUINOLINE3CARBOXYLATE
InChI=1SC28H32N2O4c163427(32)2523(18101220(335)131118)2421(1528(34)1622(24)31)30(26(25)29)1997817(2)1419h71423H6151629H215H3
MFCD01572375
ZINC000001436914
ZINC000001436915
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