Vitas-M small molecule compound
ethyl 2-amino-4-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}phenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Catalog ID
STL174679
SMILES CCOC(=O)C1=C(N)OC2=C(C1c1ccc(c(c1)COc1cccc(c1)C(F)(F)F)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 C29H30F3NO6 MW 545.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30F3NO6/c1-5-37-27(35)25-23(24-20(34)13-28(2,3)14-22(24)39-26(25)33)16-9-10-21(36-4)17(11-16)15-38-19-8-6-7-18(12-19)29(30,31)32/h6-12,23H,5,13-15,33H2,1-4H3InChIKey
KLCSSTSCRBIOQM-UHFFFAOYSA-NSynonyms
438613-68-4438613684
CCOC(=O)C1=C(OC2=C(C1C3=CC(=C(C=C3)OC)COC4=CC=CC(=C4)C(F)(F)F)C(=O)CC(C2)(C)C)N
ethyl2amino4(4methoxy3((3(trifluoromethyl)phenoxy)methyl)phenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carboxylate
ETHYL2AMINO4(4METHOXY3((3(TRIFLUOROMETHYL)PHENOXY)METHYL)PHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBOXYLATE
InChI=1SC29H30F3NO6c153727(35)2523(2420(34)1328(23)1422(24)3926(25)33)1691021(364)17(1116)15381986718(1219)29(3031)32h61223H5131533H214H3
MFCD02604982
ZINC000002727130
ZINC000002727131
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