Vitas-M small molecule compound
(R)-2-(1-((2S,3S)-3-methyl-2-(4-methylphenylsulfonamido)pentanoyl)piperidine-4-carboxamido)-3-(methylthio)propanoic acid
Catalog ID
STL547066
SMILES CSC[C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@H](C(CC)C)NS(=O)(=O)c1ccc(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 C23H35N3O6S2 MW 513.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H35N3O6S2/c1-5-16(3)20(25-34(31,32)18-8-6-15(2)7-9-18)22(28)26-12-10-17(11-13-26)21(27)24-19(14-33-4)23(29)30/h6-9,16-17,19-20,25H,5,10-14H2,1-4H3,(H,24,27)(H,29,30)/t16?,19-,20-/m0/s1InChIKey
JJAZQUDNSMPXRW-RFFXKOPCSA-NSynonyms
956942-24-8(2~(R))2((1((2~(S))3methyl2((4methylphenyl)sulfonylamino)pentanoyl)piperidine4carbonyl)amino)3methylsulfanylpropanoicacid
(R)2(1((2S3S)3methyl2(4methylphenylsulfonamido)pentanoyl)piperidine4carboxamido)3(methylthio)propanoicacid
16400788
956942248
CSC(C@@H)(C(=O)O)NC(=O)C1CCN(CC1)C(=O)(C@H)(C(CC)C)NS(=O)(=O)c1ccc(cc1)C
InChI=1SC23H35N3O6S2c1516(3)20(2534(3132)188615(2)7918)22(28)26121017(111326)21(27)2419(14334)23(29)30h691617192025H51014H214H3(H2427)(H2930)t16?1920m0s1
MFCD05672019
ZINC000008918395
ZINC000012866198
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