Vitas-M small molecule compound
S-benzyl-N-{[2-(3-hydroxy-3-methylbut-1-yn-1-yl)phenyl]carbonyl}cysteine
Catalog ID
STK185386
SMILES OC(=O)C(NC(=O)c1ccccc1C#CC(O)(C)C)CSCc1ccccc1
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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 C22H23NO4S MW 397.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO4S/c1-22(2,27)13-12-17-10-6-7-11-18(17)20(24)23-19(21(25)26)15-28-14-16-8-4-3-5-9-16/h3-11,19,27H,14-15H2,1-2H3,(H,23,24)(H,25,26)InChIKey
LGCGKVYOFMVBLF-UHFFFAOYSA-NSynonyms
3BENZYLSULFANYL2((2(3HYDROXY3METHYLBUT1YNYL)BENZOYL)AMINO)PROPANOICACID
CC(C)(C#CC1=CC=CC=C1C(=O)NC(CSCC2=CC=CC=C2)C(=O)O)O
InChI=1SC22H23NO4Sc122(227)13121710671118(17)20(24)2319(21(25)26)152814168435916h3111927H1415H212H3(H2324)(H2526)
MFCD05258214
SBENZYLN((2(3HYDROXY3METHYLBUT1YN1YL)PHENYL)CARBONYL)CYSTEINE
SBENZYLN(2(3HYDROXY3METHYLBUT1YN1YL)BENZOYL)DCYSTEINE
SBENZYLN(2(3HYDROXY3METHYLBUT1YN1YL)BENZOYL)LCYSTEINE
ZINC000082067930
ZINC000082067931
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