Vitas-M small molecule compound
methyl S-benzyl-N-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}cysteinate
Catalog ID
STK510629
SMILES COC(=O)C(NC(=O)CSc1nc(C)cc(n1)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 C19H23N3O3S2 MW 405.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O3S2/c1-13-9-14(2)21-19(20-13)27-12-17(23)22-16(18(24)25-3)11-26-10-15-7-5-4-6-8-15/h4-9,16H,10-12H2,1-3H3,(H,22,23)InChIKey
XNIYNEHVYIAWEJ-UHFFFAOYSA-NSynonyms
CC1=CC(=NC(=N1)SCC(=O)NC(CSCC2=CC=CC=C2)C(=O)OC)C
InChI=1SC19H23N3O3S2c113914(2)2119(2013)271217(23)2216(18(24)253)112610157546815h4916H1012H213H3(H2223)
methyl3benzylsulfanyl2((2(46dimethylpyrimidin2yl)sulfanylacetyl)amino)propanoate
methylSbenzylN(((46dimethylpyrimidin2yl)sulfanyl)acetyl)cysteinate
MFCD08532297
ZINC000012446243
ZINC000012446245
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