Vitas-M small molecule compound
3-butyl-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Catalog ID
STK552906
SMILES CCCCn1c(=S)[nH]c(c(c1=O)C1NCCc2c1cccc2)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 C17H21N3O2S MW 331.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O2S/c1-2-3-10-20-16(22)13(15(21)19-17(20)23)14-12-7-5-4-6-11(12)8-9-18-14/h4-7,14,18,21H,2-3,8-10H2,1H3,(H,19,23)InChIKey
OOQDQDHHGOJLLL-UHFFFAOYSA-NSynonyms
3butyl6hydroxy5(1234tetrahydroisoquinolin1yl)2thioxo23dihydropyrimidin4(1H)one
CCCCn1c(=S)(nH)c(c(c1=O)C1NCCc2c1cccc2)O
MFCD03689628
ZINC000020229577
ZINC000020229579
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