Vitas-M small molecule compound
3-(5-{(Z)-[1-(3-chlorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}furan-2-yl)benzoic acid
Catalog ID
STL431930
SMILES Clc1cccc(c1)N1NC(=O)/C(=C/c2ccc(o2)c2cccc(c2)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 C21H13ClN2O5 MW 408.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClN2O5/c22-14-5-2-6-15(10-14)24-20(26)17(19(25)23-24)11-16-7-8-18(29-16)12-3-1-4-13(9-12)21(27)28/h1-11H,(H,23,25)(H,27,28)/b17-11-InChIKey
TZBRWOWKBPIABI-BOPFTXTBSA-NSynonyms
3(5(((4Z)1(3CHLOROPHENYL)35DIOXOPYRAZOLIDIN4YLIDENE)METHYL)FURAN2YL)BENZOICACID
3(5((1(3CHLOROPHENYL)35DIOXO12DIAZOLIDIN4YLIDENE)METHYL)2FURYL)BENZOICACID
3(5((Z)(1(3chlorophenyl)35dioxopyrazolidin4ylidene)methyl)furan2yl)benzoicacid
C1=CC(=CC(=C1)C(=O)O)C2=CC=C(O2)C=C3C(=O)NN(C3=O)C4=CC(=CC=C4)Cl
CHEMICALDIVERSITYLIBRARYCOMPOUND17
Clc1cccc(c1)N1NC(=O)C(=Cc2ccc(o2)c2cccc(c2)C(=O)O)C1=O
InChI=1SC21H13ClN2O5c221452615(1014)2420(26)17(19(25)2324)11167818(2916)1231413(912)21(27)28h111H(H2325)(H2728)b1711
MFCD01785231
ZINC000012428662
ZINC12428662
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