Vitas-M small molecule compound
(2E)-3-[5-(4-chloro-3-nitrophenyl)furan-2-yl]-2-cyano-N-(4-methoxybenzyl)prop-2-enamide
Catalog ID
STK185313
SMILES N#C/C(=C\c1ccc(o1)c1ccc(c(c1)[N+](=O)[O-])Cl)/C(=O)NCc1ccc(cc1)OC
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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 C22H16ClN3O5 MW 437.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O5/c1-30-17-5-2-14(3-6-17)13-25-22(27)16(12-24)10-18-7-9-21(31-18)15-4-8-19(23)20(11-15)26(28)29/h2-11H,13H2,1H3,(H,25,27)/b16-10+InChIKey
WEBLOQSIAVQSFD-MHWRWJLKSA-NSynonyms
(2E)3(5(4CHLORO3NITROPHENYL)FURAN2YL)2CYANON(4METHOXYBENZYL)PROP2ENAMIDE
(E)3(5(4CHLORO3NITROPHENYL)FURAN2YL)2CYANON((4METHOXYPHENYL)METHYL)PROP2ENAMIDE
COC1=CC=C(C=C1)CNC(=O)C(=CC2=CC=C(O2)C3=CC(=C(C=C3)Cl)(N+)(=O)(O))C#N
InChI=1SC22H16ClN3O5c130175214(3617)132522(27)16(1224)10187921(3118)154819(23)20(1115)26(28)29h211H13H21H3(H2527)b1610+
MFCD03703950
N#CC(=Cc1ccc(o1)c1ccc(c(c1)(N+)(=O)(O))Cl)C(=O)NCc1ccc(cc1)OC
ZINC000001106095
ZINC01106095
ZINC1106095
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