Vitas-M small molecule compound
methyl 2-chloro-5-[(3Z)-3-{[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl]benzoate
Catalog ID
STK199230
SMILES COC(=O)c1cc(ccc1Cl)N1C(=O)/C(=C\c2ccc(o2)c2cc(Cl)ccc2Cl)/C=C1c1ccccc1
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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 C29H18Cl3NO4 MW 550.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H18Cl3NO4/c1-36-29(35)23-16-20(8-11-25(23)32)33-26(17-5-3-2-4-6-17)14-18(28(33)34)13-21-9-12-27(37-21)22-15-19(30)7-10-24(22)31/h2-16H,1H3/b18-13-InChIKey
VQELSDLTJIBNDK-AQTBWJFISA-NSynonyms
COC(=O)C1=C(C=CC(=C1)N2C(=CC(=CC3=CC=C(O3)C4=C(C=CC(=C4)Cl)Cl)C2=O)C5=CC=CC=C5)Cl
COC(=O)c1cc(ccc1Cl)N1C(=O)C(=Cc2ccc(o2)c2cc(Cl)ccc2Cl)C=C1c1ccccc1
InChI=1SC29H18Cl3NO4c13629(35)231620(81125(23)32)3326(175324617)1418(28(33)34)132191227(3721)221519(30)71024(22)31h216H1H3b1813
METHYL2CHLORO5((3Z)3((5(25DICHLOROPHENYL)FURAN2YL)METHYLIDENE)2OXO5PHENYL23DIHYDRO1HPYRROL1YL)BENZOATE
METHYL2CHLORO5((3Z)3((5(25DICHLOROPHENYL)FURAN2YL)METHYLIDENE)2OXO5PHENYLPYRROL1YL)BENZOATE
MFCD06666127
ZINC000097960944
ZINC97960944
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