Vitas-M small molecule compound
4-[4-(benzyloxy)-3-methoxyphenyl]-2,7,7-trimethyl-3-(morpholin-4-ylcarbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Catalog ID
STK327112
SMILES COc1cc(ccc1OCc1ccccc1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)N1CCOCC1
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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 C31H36N2O5 MW 516.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N2O5/c1-20-27(30(35)33-12-14-37-15-13-33)28(29-23(32-20)17-31(2,3)18-24(29)34)22-10-11-25(26(16-22)36-4)38-19-21-8-6-5-7-9-21/h5-11,16,28,32H,12-15,17-19H2,1-4H3InChIKey
XWDJBESBZVNGAR-UHFFFAOYSA-NSynonyms
4(3methoxy4phenylmethoxyphenyl)277trimethyl3(morpholine4carbonyl)1468tetrahydroquinolin5one
4(4(benzyloxy)3methoxyphenyl)277trimethyl3(morpholin4ylcarbonyl)4678tetrahydroquinolin5(1H)one
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=O)N5CCOCC5
InChI=1SC31H36N2O5c12027(30(35)33121437151333)28(2923(3220)1731(23)1824(29)34)22101125(26(1622)364)3819218657921h511162832H12151719H214H3
MFCD03632533
ZINC000000729421
ZINC000019901250
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