Vitas-M small molecule compound
(2E)-N-(3,5-dimethylphenyl)-3-(4-fluorophenyl)prop-2-enamide
Catalog ID
STK489928
SMILES O=C(Nc1cc(C)cc(c1)C)/C=C/c1ccc(cc1)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 C17H16FNO MW 269.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FNO/c1-12-9-13(2)11-16(10-12)19-17(20)8-5-14-3-6-15(18)7-4-14/h3-11H,1-2H3,(H,19,20)/b8-5+InChIKey
ULCUXKTWYPHJRL-VMPITWQZSA-NSynonyms
(2E)N(35dimethylphenyl)3(4fluorophenyl)prop2enamide
(E)N(35DIMETHYLPHENYL)3(4FLUOROPHENYL)PROP2ENAMIDE
CC1=CC(=CC(=C1)NC(=O)C=CC2=CC=C(C=C2)F)C
InChI=1SC17H16FNOc112913(2)1116(1012)1917(20)85143615(18)7414h311H12H3(H1920)b85+
MFCD01353686
O=C(Nc1cc(C)cc(c1)C)C=Cc1ccc(cc1)F
ZINC000000512653
ZINC00512653
ZINC512653
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