Vitas-M small molecule compound
4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2,7,7-trimethyl-3-(morpholin-4-ylcarbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Catalog ID
STK404025
SMILES CCOc1cc(cc(c1O)Br)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 C25H31BrN2O5 MW 519.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31BrN2O5/c1-5-33-19-11-15(10-16(26)23(19)30)21-20(24(31)28-6-8-32-9-7-28)14(2)27-17-12-25(3,4)13-18(29)22(17)21/h10-11,21,27,30H,5-9,12-13H2,1-4H3InChIKey
RLZVFCMAUFXKQR-UHFFFAOYSA-NSynonyms
4(3bromo5ethoxy4hydroxyphenyl)277trimethyl3(morpholin4ylcarbonyl)4678tetrahydroquinolin5(1H)one
4(3bromo5ethoxy4hydroxyphenyl)277trimethyl3(morpholine4carbonyl)1468tetrahydroquinolin5one
CCOC1=C(C(=CC(=C1)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)N4CCOCC4)C)Br)O
InChI=1SC25H31BrN2O5c1533191115(1016(26)23(19)30)2120(24(31)2868329728)14(2)27171225(34)1318(29)22(17)21h1011212730H591213H214H3
MFCD03996398
ZINC000009497445
ZINC000009497449
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