Vitas-M small molecule compound
2-[(4,6-dihydroxypyrimidin-2-yl)sulfanyl]-1-(2,2,4-trimethylquinolin-1(2H)-yl)ethanone
Catalog ID
STL361695
SMILES O=C(N1c2ccccc2C(=CC1(C)C)C)CSc1nc(O)cc(n1)O
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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 C18H19N3O3S MW 357.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O3S/c1-11-9-18(2,3)21(13-7-5-4-6-12(11)13)16(24)10-25-17-19-14(22)8-15(23)20-17/h4-9H,10H2,1-3H3,(H2,19,20,22,23)InChIKey
UWBHYKWNJWETJN-UHFFFAOYSA-NSynonyms
2((46dihydroxypyrimidin2yl)sulfanyl)1(224trimethylquinolin1(2H)yl)ethanone
4hydroxy2(2oxo2(224trimethylquinolin1yl)ethyl)sulfanyl1Hpyrimidin6one
CC1=CC(N(C2=CC=CC=C12)C(=O)CSC3=NC(=CC(=O)N3)O)(C)C
InChI=1SC18H19N3O3Sc111918(23)21(13754612(11)13)16(24)1025171914(22)815(23)2017h49H10H213H3(H219202223)
MFCD28033871
ZINC000095115662
ZINC95115662
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