Vitas-M small molecule compound
(2E)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-2-cyano-N-(4-methoxybenzyl)prop-2-enamide
Catalog ID
STK185280
SMILES COc1ccc(cc1)CNC(=O)/C(=C/c1ccc(o1)c1ccc(cc1Cl)[N+](=O)[O-])/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 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)15(12-24)10-18-7-9-21(31-18)19-8-4-16(26(28)29)11-20(19)23/h2-11H,13H2,1H3,(H,25,27)/b15-10+InChIKey
MDEOLWJYGDZZRY-XNTDXEJSSA-NSynonyms
(2E)3(5(2CHLORO4NITROPHENYL)FURAN2YL)2CYANON(4METHOXYBENZYL)PROP2ENAMIDE
(E)3(5(2CHLORO4NITROPHENYL)FURAN2YL)2CYANON((4METHOXYPHENYL)METHYL)PROP2ENAMIDE
COC1=CC=C(C=C1)CNC(=O)C(=CC2=CC=C(O2)C3=C(C=C(C=C3)(N+)(=O)(O))Cl)C#N
COc1ccc(cc1)CNC(=O)C(=Cc1ccc(o1)c1ccc(cc1Cl)(N+)(=O)(O))C#N
InChI=1SC22H16ClN3O5c130175214(3617)132522(27)15(1224)10187921(3118)198416(26(28)29)1120(19)23h211H13H21H3(H2527)b1510+
MFCD03729651
ZINC000009261739
ZINC09261739
ZINC9261739
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