Vitas-M small molecule compound
3-{2-[(Z)-{2,4-dioxo-3-[2-oxo-2-(phenylamino)ethyl]-1,3-thiazolidin-5-ylidene}methyl]-1H-pyrrol-1-yl}benzoic acid
Catalog ID
STK110599
SMILES O=C(CN1C(=O)S/C(=C\c2cccn2c2cccc(c2)C(=O)O)/C1=O)Nc1ccccc1
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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 C23H17N3O5S MW 447.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O5S/c27-20(24-16-7-2-1-3-8-16)14-26-21(28)19(32-23(26)31)13-18-10-5-11-25(18)17-9-4-6-15(12-17)22(29)30/h1-13H,14H2,(H,24,27)(H,29,30)/b19-13-InChIKey
UCENZZDPUCPHOW-UYRXBGFRSA-NSynonyms
3(2((Z)(24DIOXO3(2OXO2(PHENYLAMINO)ETHYL)13THIAZOLIDIN5YLIDENE)METHYL)1HPYRROL1YL)BENZOICACID
3(2((Z)(3(2anilino2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)pyrrol1yl)benzoicacid
C1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CC3=CC=CN3C4=CC=CC(=C4)C(=O)O)SC2=O
InChI=1SC23H17N3O5Sc2720(24167213816)142621(28)19(3223(26)31)13181051125(18)1794615(1217)22(29)30h113H14H2(H2427)(H2930)b1913
MFCD04126897
O=C(CN1C(=O)SC(=Cc2cccn2c2cccc(c2)C(=O)O)C1=O)Nc1ccccc1
ZINC000012468173
ZINC12468173
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