Vitas-M small molecule compound
diethyl 2-amino-7-(3-methoxyphenyl)-5-oxo-1-phenyl-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK682780
SMILES CCOC(=O)C1C(CC2=C(C1=O)C(c1cccnc1)C(=C(N2c1ccccc1)N)C(=O)OCC)c1cccc(c1)OC
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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 C33H33N3O6 MW 567.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33N3O6/c1-4-41-32(38)27-24(20-11-9-15-23(17-20)40-3)18-25-28(30(27)37)26(21-12-10-16-35-19-21)29(33(39)42-5-2)31(34)36(25)22-13-7-6-8-14-22/h6-17,19,24,26-27H,4-5,18,34H2,1-3H3InChIKey
XIPFZPFUHVEWEL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1C(CC2=C(C1=O)C(C(=C(N2C3=CC=CC=C3)N)C(=O)OCC)C4=CN=CC=C4)C5=CC(=CC=C5)OC
diethyl2amino7(3methoxyphenyl)5oxo1phenyl4(pyridin3yl)145678hexahydroquinoline36dicarboxylate
diethyl2amino7(3methoxyphenyl)5oxo1phenyl4pyridin3yl4678tetrahydroquinoline36dicarboxylate
InChI=1SC33H33N3O6c144132(38)2724(201191523(1720)403)182528(30(27)37)26(21121016351921)29(33(39)4252)31(34)36(25)22137681422h61719242627H451834H213H3
MFCD04060777
ZINC000001445786
ZINC000103008469
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