Vitas-M small molecule compound
2-{5-[(Z)-(3-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoic acid
Catalog ID
STL380832
SMILES O=C(CN1C(=O)S/C(=C\c2ccc(o2)c2ccccc2C(=O)O)/C1=O)Nc1ccc(cc1)C
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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 C24H18N2O6S MW 462.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N2O6S/c1-14-6-8-15(9-7-14)25-21(27)13-26-22(28)20(33-24(26)31)12-16-10-11-19(32-16)17-4-2-3-5-18(17)23(29)30/h2-12H,13H2,1H3,(H,25,27)(H,29,30)/b20-12-InChIKey
ILPPXMQGFBCMBW-NDENLUEZSA-NSynonyms
2(5((Z)(3(2((4methylphenyl)amino)2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)furan2yl)benzoicacid
2(5((Z)(3(2(4methylanilino)2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)furan2yl)benzoicacid
CC1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CC3=CC=C(O3)C4=CC=CC=C4C(=O)O)SC2=O
InChI=1SC24H18N2O6Sc1146815(9714)2521(27)132622(28)20(3324(26)31)1216101119(3216)17423518(17)23(29)30h212H13H21H3(H2527)(H2930)b2012
MFCD28951172
O=C(CN1C(=O)SC(=Cc2ccc(o2)c2ccccc2C(=O)O)C1=O)Nc1ccc(cc1)C
ZINC000016293040
ZINC16293040
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