Vitas-M small molecule compound
4-{2-[(Z)-(3-{2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-1H-pyrrol-1-yl}benzoic acid
Catalog ID
STK190289
SMILES O=C(Nc1ccc(cc1C)C)CN1C(=O)S/C(=C\c2cccn2c2ccc(cc2)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 C25H21N3O5S MW 475.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O5S/c1-15-5-10-20(16(2)12-15)26-22(29)14-28-23(30)21(34-25(28)33)13-19-4-3-11-27(19)18-8-6-17(7-9-18)24(31)32/h3-13H,14H2,1-2H3,(H,26,29)(H,31,32)/b21-13-InChIKey
CUKHQAWRPMYXME-BKUYFWCQSA-NSynonyms
4(2((Z)(3(2((24DIMETHYLPHENYL)AMINO)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)1HPYRROL1YL)BENZOICACID
4(2((Z)(3(2(24dimethylanilino)2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)pyrrol1yl)benzoicacid
CC1=CC(=C(C=C1)NC(=O)CN2C(=O)C(=CC3=CC=CN3C4=CC=C(C=C4)C(=O)O)SC2=O)C
InChI=1SC25H21N3O5Sc11551020(16(2)1215)2622(29)142823(30)21(3425(28)33)1319431127(19)188617(7918)24(31)32h313H14H212H3(H2629)(H3132)b2113
MFCD07115352
O=C(Nc1ccc(cc1C)C)CN1C(=O)SC(=Cc2cccn2c2ccc(cc2)C(=O)O)C1=O
ZINC000019877943
ZINC19877943
Check stock
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Check stock on Vitas-MAvailable files
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