Vitas-M small molecule compound

ethyl beta-hydroxy-3-nitro-N-{4-oxo-4-[(4-sulfamoylphenyl)amino]butanoyl}tyrosinate

Catalog ID
STL324236
SMILES CCOC(=O)C(C(c1ccc(c(c1)[N+](=O)[O-])O)O)NC(=O)CCC(=O)Nc1ccc(cc1)S(=O)(=O)N

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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 C21H24N4O10S MW 524.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O10S/c1-2-35-21(30)19(20(29)12-3-8-16(26)15(11-12)25(31)32)24-18(28)10-9-17(27)23-13-4-6-14(7-5-13)36(22,33)34/h3-8,11,19-20,26,29H,2,9-10H2,1H3,(H,23,27)(H,24,28)(H2,22,33,34)
InChIKey
RMWOBKBRQYCIRT-UHFFFAOYSA-N
Synonyms
1214067-82-9
1214067829
CCOC(=O)C(C(C1=CC(=C(C=C1)O)(N+)(=O)(O))O)NC(=O)CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N
CCOC(=O)C(C(c1ccc(c(c1)(N+)(=O)(O))O)O)NC(=O)CCC(=O)Nc1ccc(cc1)S(=O)(=O)N
ETHYL3HYDROXY3(4HYDROXY3NITROPHENYL)2((4OXO4(4SULFAMOYLANILINO)BUTANOYL)AMINO)PROPANOATE
ethyl3hydroxy3(4hydroxy3nitrophenyl)2(4oxo4((4sulfamoylphenyl)amino)butanamido)propanoate
ethylbetahydroxy3nitroN(4oxo4((4sulfamoylphenyl)amino)butanoyl)tyrosinate
InChI=1SC21H24N4O10Sc123521(30)19(20(29)123816(26)15(1112)25(31)32)2418(28)10917(27)23134614(7513)36(2233)34h381119202629H2910H21H3(H2327)(H2428)(H2223334)
MFCD01030246
ZINC000097949581
ZINC000097949584

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Available files

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