Vitas-M small molecule compound
2-{5-[(Z)-{2-[(3-methylphenyl)amino]-4-oxo-1,3-thiazol-5(4H)-ylidene}methyl]furan-2-yl}benzoic acid
Catalog ID
STL492929
SMILES Cc1cccc(c1)NC1=NC(=O)/C(=C/c2ccc(o2)c2ccccc2C(=O)O)/S1
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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 C22H16N2O4S MW 404.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N2O4S/c1-13-5-4-6-14(11-13)23-22-24-20(25)19(29-22)12-15-9-10-18(28-15)16-7-2-3-8-17(16)21(26)27/h2-12H,1H3,(H,26,27)(H,23,24,25)/b19-12-InChIKey
AYCJUCLNSTWANL-UNOMPAQXSA-NSynonyms
2(5((Z)(2((3methylphenyl)amino)4oxo13thiazol5(4H)ylidene)methyl)furan2yl)benzoicacid
2(5((Z)(2(3METHYLANILINO)4OXO13THIAZOL5YLIDENE)METHYL)FURAN2YL)BENZOICACID
CC1=CC(=CC=C1)NC2=NC(=O)C(=CC3=CC=C(O3)C4=CC=CC=C4C(=O)O)S2
Cc1cccc(c1)NC1=NC(=O)C(=Cc2ccc(o2)c2ccccc2C(=O)O)S1
InChI=1SC22H16N2O4Sc11354614(1113)23222420(25)19(2922)121591018(2815)16723817(16)21(26)27h212H1H3(H2627)(H232425)b1912
MFCD30715446
ZINC000005705371
ZINC5705371
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