Vitas-M small molecule compound
methyl N-{[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]acetyl}phenylalaninate
Catalog ID
STK692286
SMILES COC(=O)C(Cc1ccccc1)NC(=O)CSc1[nH]c(c(n1)C)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 C17H21N3O3S MW 347.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O3S/c1-11-12(2)19-17(18-11)24-10-15(21)20-14(16(22)23-3)9-13-7-5-4-6-8-13/h4-8,14H,9-10H2,1-3H3,(H,18,19)(H,20,21)InChIKey
NBVMEESULGQAID-UHFFFAOYSA-NSynonyms
CC1=C(N=C(N1)SCC(=O)NC(CC2=CC=CC=C2)C(=O)OC)C
COC(=O)C(Cc1ccccc1)NC(=O)CSc1(nH)c(c(n1)C)C
InChI=1SC17H21N3O3Sc11112(2)1917(1811)241015(21)2014(16(22)233)9137546813h4814H910H213H3(H1819)(H2021)
methyl2((2((45dimethyl1Himidazol2yl)sulfanyl)acetyl)amino)3phenylpropanoate
methylN(((45dimethyl1Himidazol2yl)sulfanyl)acetyl)phenylalaninate
MFCD10038194
ZINC000015082951
ZINC000015082953
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