Vitas-M small molecule compound
4-(3-{(E)-[2,4-dioxo-3-(propan-2-yl)-1,3-thiazolidin-5-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid
Catalog ID
STK178012
SMILES CC(N1C(=O)S/C(=C/c2cc(n(c2C)c2ccc(cc2)C(=O)O)C)/C1=O)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 C20H20N2O4S MW 384.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O4S/c1-11(2)21-18(23)17(27-20(21)26)10-15-9-12(3)22(13(15)4)16-7-5-14(6-8-16)19(24)25/h5-11H,1-4H3,(H,24,25)/b17-10+InChIKey
GUQDNDPOTLZIDP-LICLKQGHSA-NSynonyms
4(3((E)(24DIOXO3(PROPAN2YL)13THIAZOLIDIN5YLIDENE)METHYL)25DIMETHYL1HPYRROL1YL)BENZOICACID
4(3((E)(24DIOXO3PROPAN2YL13THIAZOLIDIN5YLIDENE)METHYL)25DIMETHYLPYRROL1YL)BENZOICACID
CC(N1C(=O)SC(=Cc2cc(n(c2C)c2ccc(cc2)C(=O)O)C)C1=O)C
CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)O)C)C=C3C(=O)N(C(=O)S3)C(C)C
InChI=1SC20H20N2O4Sc111(2)2118(23)17(2720(21)26)1015912(3)22(13(15)4)167514(6816)19(24)25h511H14H3(H2425)b1710+
MFCD03699958
ZINC000004704800
ZINC4704800
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