Vitas-M small molecule compound
3-methylbutyl (2E)-2-cyano-3-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}prop-2-enoate
Catalog ID
STK949480
SMILES N#C/C(=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)/C(=O)OCCC(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 C20H18F3NO3 MW 377.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18F3NO3/c1-13(2)8-9-26-19(25)15(12-24)11-17-6-7-18(27-17)14-4-3-5-16(10-14)20(21,22)23/h3-7,10-11,13H,8-9H2,1-2H3/b15-11+InChIKey
DKQQCQZTZMHBMS-RVDMUPIBSA-NSynonyms
3METHYLBUTYL(2E)2CYANO3(5(3(TRIFLUOROMETHYL)PHENYL)(2FURYL))PROP2ENOATE
3methylbutyl(2E)2cyano3(5(3(trifluoromethyl)phenyl)furan2yl)prop2enoate
3METHYLBUTYL(E)2CYANO3(5(3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)PROP2ENOATE
CC(C)CCOC(=O)C(=CC1=CC=C(O1)C2=CC(=CC=C2)C(F)(F)F)C#N
InChI=1SC20H18F3NO3c113(2)892619(25)15(1224)11176718(2717)1443516(1014)20(2122)23h37101113H89H212H3b1511+
MFCD01918504
N#CC(=Cc1ccc(o1)c1cccc(c1)C(F)(F)F)C(=O)OCCC(C)C
ZINC000002669732
ZINC02669732
ZINC2669732
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