Vitas-M small molecule compound
butyl (2E)-3-[5-(4-bromophenyl)furan-2-yl]-2-cyanoprop-2-enoate
Catalog ID
STK731822
SMILES CCCCOC(=O)/C(=C/c1ccc(o1)c1ccc(cc1)Br)/C#N
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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 C18H16BrNO3 MW 374.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrNO3/c1-2-3-10-22-18(21)14(12-20)11-16-8-9-17(23-16)13-4-6-15(19)7-5-13/h4-9,11H,2-3,10H2,1H3/b14-11+InChIKey
TXWZMVYTJBPUTG-SDNWHVSQSA-NSynonyms
BUTYL(2E)3(5(4BROMOPHENYL)(2FURYL))2CYANOPROP2ENOATE
butyl(2E)3(5(4bromophenyl)furan2yl)2cyanoprop2enoate
BUTYL(E)3(5(4BROMOPHENYL)FURAN2YL)2CYANOPROP2ENOATE
CCCCOC(=O)C(=CC1=CC=C(O1)C2=CC=C(C=C2)Br)C#N
CCCCOC(=O)C(=Cc1ccc(o1)c1ccc(cc1)Br)C#N
InChI=1SC18H16BrNO3c123102218(21)14(1220)11168917(2316)134615(19)7513h4911H2310H21H3b1411+
MFCD01918462
ZINC000002669606
ZINC02669606
ZINC2669606
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