Vitas-M small molecule compound
2-(3-methoxy-4-{[(4-nitrophenyl)carbonyl]oxy}phenyl)-1,3-thiazolidine-4-carboxylic acid
Catalog ID
STK383900
SMILES COc1cc(ccc1OC(=O)c1ccc(cc1)[N+](=O)[O-])C1SCC(N1)C(=O)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 C18H16N2O7S MW 404.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O7S/c1-26-15-8-11(16-19-13(9-28-16)17(21)22)4-7-14(15)27-18(23)10-2-5-12(6-3-10)20(24)25/h2-8,13,16,19H,9H2,1H3,(H,21,22)InChIKey
OSIXKNMNHWPRQP-UHFFFAOYSA-NSynonyms
1048037-29-11048037291
2(3methoxy4(((4nitrophenyl)carbonyl)oxy)phenyl)13thiazolidine4carboxylicacid
2(3METHOXY4(4NITROBENZOYL)OXYPHENYL)13THIAZOLIDINE4CARBOXYLICACID
2(3METHOXY4(4NITROPHENYLCARBONYLOXY)PHENYL)13THIAZOLIDINE4CARBOXYLICACID
COC1=C(C=CC(=C1)C2NC(CS2)C(=O)O)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
COc1cc(ccc1OC(=O)c1ccc(cc1)(N+)(=O)(O))C1SCC(N1)C(=O)O
InChI=1SC18H16N2O7Sc12615811(161913(92816)17(21)22)4714(15)2718(23)102512(6310)20(24)25h28131619H9H21H3(H2122)
MFCD03836506
ZINC000004554631
ZINC000004554634
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