Vitas-M small molecule compound
3-({4-[(Z)-(3-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzoic acid
Catalog ID
STK078250
SMILES O=C(CN1C(=O)S/C(=C\c2ccc(cc2)OCc2cccc(c2)C(=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 C27H22N2O6S MW 502.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O6S/c1-17-5-9-21(10-6-17)28-24(30)15-29-25(31)23(36-27(29)34)14-18-7-11-22(12-8-18)35-16-19-3-2-4-20(13-19)26(32)33/h2-14H,15-16H2,1H3,(H,28,30)(H,32,33)/b23-14-InChIKey
HQXATXXWLVYWGT-UCQKPKSFSA-NSynonyms
3((4((Z)(3(2((4METHYLPHENYL)AMINO)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
3((4((Z)(3(2(4METHYLANILINO)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
CC1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CC3=CC=C(C=C3)OCC4=CC=CC(=C4)C(=O)O)SC2=O
InChI=1SC27H22N2O6Sc1175921(10617)2824(30)152925(31)23(3627(29)34)141871122(12818)35161932420(1319)26(32)33h214H1516H21H3(H2830)(H3233)b2314
MFCD03080992
O=C(CN1C(=O)SC(=Cc2ccc(cc2)OCc2cccc(c2)C(=O)O)C1=O)Nc1ccc(cc1)C
STK078250
ZINC000009311670
ZINC9311670
Check stock
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Check stock on Vitas-MAvailable files
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