Vitas-M small molecule compound
2-methylpropyl 4-[4-(dimethylamino)phenyl]-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK040291
SMILES CC(COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)N(C)C)C(=O)CC(C2)c1ccccc1)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 C29H34N2O3 MW 458.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O3/c1-18(2)17-34-29(33)26-19(3)30-24-15-22(20-9-7-6-8-10-20)16-25(32)28(24)27(26)21-11-13-23(14-12-21)31(4)5/h6-14,18,22,27,30H,15-17H2,1-5H3InChIKey
UYIDVDGXEQRZAV-UHFFFAOYSA-NSynonyms
2methylpropyl4(4(dimethylamino)phenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
2methylpropyl4(4(dimethylamino)phenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
CC(COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)N(C)C)C(=O)CC(C2)c1ccccc1)C
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=C(C=C4)N(C)C)C(=O)OCC(C)C
InChI=1SC29H34N2O3c118(2)173429(33)2619(3)30241522(2097681020)1625(32)28(24)27(26)21111323(141221)31(4)5h61418222730H1517H215H3
MFCD01445637
STK040291
ZINC000000847649
ZINC000000847652
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