Vitas-M small molecule compound
(3aS,6R)-N-[2-(1H-indol-3-yl)ethyl]-1-oxo-2-[3-(trifluoromethyl)phenyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Catalog ID
STK612843
SMILES O=C(C1[C@@H]2C=C[C@@]3(C1C(=O)N(C3)c1cccc(c1)C(F)(F)F)O2)NCCc1c[nH]c2c1cccc2
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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 C26H22F3N3O3 MW 481.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22F3N3O3/c27-26(28,29)16-4-3-5-17(12-16)32-14-25-10-8-20(35-25)21(22(25)24(32)34)23(33)30-11-9-15-13-31-19-7-2-1-6-18(15)19/h1-8,10,12-13,20-22,31H,9,11,14H2,(H,30,33)/t20-,21?,22?,25-/m1/s1InChIKey
QQFCFIPUBLIESM-YSDSZHATSA-NSynonyms
1212455-92-9(3aS6R)N(2(1Hindol3yl)ethyl)1oxo2(3(trifluoromethyl)phenyl)123677ahexahydro3a6epoxyisoindole7carboxamide
1212455929
MFCD18246281
O=C((C@@H)1(C@H)2C=C(C@@)3((C@H)1C(=O)N(C3)c1cccc(c1)C(F)(F)F)O2)NCCc1c(nH)c2c1cccc2
O=C(C1(C@@H)2C=C(C@@)3(C1C(=O)N(C3)c1cccc(c1)C(F)(F)F)O2)NCCc1c(nH)c2c1cccc2
ZINC000009183968
ZINC000013625865
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