Vitas-M small molecule compound
ethyl 2-amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxo-1-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK756157
SMILES CCOC(=O)C1=C(N)N(c2ccccc2)C2=C(C1c1ccc(c(c1)OC)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 C28H32N2O5 MW 476.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2O5/c1-6-35-27(32)25-23(17-12-13-21(33-4)22(14-17)34-5)24-19(15-28(2,3)16-20(24)31)30(26(25)29)18-10-8-7-9-11-18/h7-14,23H,6,15-16,29H2,1-5H3InChIKey
XVBAPHSVOPUAJL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=C(C1C3=CC(=C(C=C3)OC)OC)C(=O)CC(C2)(C)C)C4=CC=CC=C4)N
ethyl2amino4(34dimethoxyphenyl)77dimethyl5oxo1phenyl145678hexahydroquinoline3carboxylate
ETHYL2AMINO4(34DIMETHOXYPHENYL)77DIMETHYL5OXO1PHENYL68DIHYDRO4HQUINOLINE3CARBOXYLATE
InChI=1SC28H32N2O5c163527(32)2523(17121321(334)22(1417)345)2419(1528(23)1620(24)31)30(26(25)29)18108791118h71423H6151629H215H3
MFCD01233728
ZINC000001436465
ZINC000001436466
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