Vitas-M small molecule compound
(4-{(E)-[5-(4-chlorophenyl)-2-oxofuran-3(2H)-ylidene]methyl}-2-ethoxyphenoxy)acetonitrile
Catalog ID
STK055998
SMILES CCOc1cc(ccc1OCC#N)/C=C/1\C=C(OC1=O)c1ccc(cc1)Cl
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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 C21H16ClNO4 MW 381.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClNO4/c1-2-25-20-12-14(3-8-18(20)26-10-9-23)11-16-13-19(27-21(16)24)15-4-6-17(22)7-5-15/h3-8,11-13H,2,10H2,1H3/b16-11+InChIKey
OPNILPCXBWQVLR-LFIBNONCSA-NSynonyms
357947-93-4(4((E)(5(4CHLOROPHENYL)2OXOFURAN3(2H)YLIDENE)METHYL)2ETHOXYPHENOXY)ACETONITRILE
2(4((5(4CHLOROPHENYL)2OXO(3FURYLIDENE))METHYL)2ETHOXYPHENOXY)ETHANENITRILE
2(4((E)(5(4CHLOROPHENYL)2OXOFURAN3YLIDENE)METHYL)2ETHOXYPHENOXY)ACETONITRILE
357947934
CCOC1=C(C=CC(=C1)C=C2C=C(OC2=O)C3=CC=C(C=C3)Cl)OCC#N
CCOc1cc(ccc1OCC#N)C=C1C=C(OC1=O)c1ccc(cc1)Cl
InChI=1SC21H16ClNO4c1225201214(3818(20)2610923)11161319(2721(16)24)154617(22)7515h381113H210H21H3b1611+
MFCD03044416
STK055998
ZINC000003766562
ZINC03766562
ZINC3766562
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