Vitas-M small molecule compound
2-[(5-benzyl-4-hydroxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide
Catalog ID
STK211789
SMILES O=C(Nc1nnc(s1)SCc1ccccc1)CSc1nc(O)c(c(=O)[nH]1)Cc1ccccc1
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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 C22H19N5O3S3 MW 497.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N5O3S3/c28-17(23-21-26-27-22(33-21)32-12-15-9-5-2-6-10-15)13-31-20-24-18(29)16(19(30)25-20)11-14-7-3-1-4-8-14/h1-10H,11-13H2,(H,23,26,28)(H2,24,25,29,30)InChIKey
PPCLMRYXJWVGGW-UHFFFAOYSA-NSynonyms
709004-15-92((5BENZYL4HYDROXY6OXO16DIHYDRO2PYRIMIDINYL)THIO)N(5(BENZYLTHIO)134THIADIAZOL2YL)ACETAMIDE
2((5BENZYL4HYDROXY6OXO16DIHYDROPYRIMIDIN2YL)SULFANYL)N(5(BENZYLSULFANYL)134THIADIAZOL2YL)ACETAMIDE
2((5BENZYL4HYDROXY6OXO1HPYRIMIDIN2YL)SULFANYL)N(5BENZYLSULFANYL134THIADIAZOL2YL)ACETAMIDE
709004159
C1=CC=C(C=C1)CC2=C(N=C(NC2=O)SCC(=O)NC3=NN=C(S3)SCC4=CC=CC=C4)O
InChI=1SC22H19N5O3S3c2817(2321262722(3321)32121595261015)1331202418(29)16(19(30)2520)11147314814h110H1113H2(H232628)(H224252930)
MFCD05993994
O=C(Nc1nnc(s1)SCc1ccccc1)CSc1nc(O)c(c(=O)(nH)1)Cc1ccccc1
ZINC000013544920
ZINC13544920
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