Vitas-M small molecule compound
N-[1-benzyl-5-methyl-2-oxo-4-(phenylcarbonyl)-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl]-3,4-dimethoxybenzamide
Catalog ID
STK683343
SMILES COc1cc(ccc1OC)C(=O)NC1(C(=O)N(C(=C1C(=O)c1ccccc1)C)Cc1ccccc1)C(F)(F)F
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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 C29H25F3N2O5 MW 538.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25F3N2O5/c1-18-24(25(35)20-12-8-5-9-13-20)28(29(30,31)32,27(37)34(18)17-19-10-6-4-7-11-19)33-26(36)21-14-15-22(38-2)23(16-21)39-3/h4-16H,17H2,1-3H3,(H,33,36)InChIKey
OFIGJBVBMCKXDS-UHFFFAOYSA-NSynonyms
CC1=C(C(C(=O)N1CC2=CC=CC=C2)(C(F)(F)F)NC(=O)C3=CC(=C(C=C3)OC)OC)C(=O)C4=CC=CC=C4
InChI=1SC29H25F3N2O5c11824(25(35)20128591320)28(29(3031)3227(37)34(18)1719106471119)3326(36)21141522(382)23(1621)393h416H17H213H3(H3336)
MFCD05257471
N(1benzyl5methyl2oxo4(phenylcarbonyl)3(trifluoromethyl)23dihydro1Hpyrrol3yl)34dimethoxybenzamide
N(4BENZOYL1BENZYL5METHYL2OXO3(TRIFLUOROMETHYL)PYRROL3YL)34DIMETHOXYBENZAMIDE
ZINC000098006025
ZINC000098006026
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