Vitas-M small molecule compound
3-(5-{(E)-[1-(3-chlorophenyl)-2,5-dioxoimidazolidin-4-ylidene]methyl}furan-2-yl)-4-methylbenzoic acid
Catalog ID
STK162441
SMILES Clc1cccc(c1)N1C(=O)N/C(=C/c2ccc(o2)c2cc(ccc2C)C(=O)O)/C1=O
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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 C22H15ClN2O5 MW 422.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClN2O5/c1-12-5-6-13(21(27)28)9-17(12)19-8-7-16(30-19)11-18-20(26)25(22(29)24-18)15-4-2-3-14(23)10-15/h2-11H,1H3,(H,24,29)(H,27,28)/b18-11+InChIKey
UQMQTLWIOGHDEF-WOJGMQOQSA-NSynonyms
3(5((E)(1(3CHLOROPHENYL)25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)FURAN2YL)4METHYLBENZOICACID
CC1=C(C=C(C=C1)C(=O)O)C2=CC=C(O2)C=C3C(=O)N(C(=O)N3)C4=CC(=CC=C4)Cl
Clc1cccc(c1)N1C(=O)NC(=Cc2ccc(o2)c2cc(ccc2C)C(=O)O)C1=O
InChI=1SC22H15ClN2O5c1125613(21(27)28)917(12)198716(3019)111820(26)25(22(29)2418)1542314(23)1015h211H1H3(H2429)(H2728)b1811+
MFCD03923398
ZINC000003652633
ZINC3652633
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