Vitas-M small molecule compound
6-hydroxy-1,3-bis(4-methoxyphenyl)-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Catalog ID
STK558383
SMILES COc1ccc(cc1)n1c(O)c(C2NCCc3c2cccc3)c(=O)n(c1=S)c1ccc(cc1)OC
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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 C27H25N3O4S MW 487.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O4S/c1-33-20-11-7-18(8-12-20)29-25(31)23(24-22-6-4-3-5-17(22)15-16-28-24)26(32)30(27(29)35)19-9-13-21(34-2)14-10-19/h3-14,24,28,31H,15-16H2,1-2H3InChIKey
CBGXKFMGXUVBLX-UHFFFAOYSA-NSynonyms
578736-37-5578736375
6hydroxy13bis(4methoxyphenyl)2sulfanylidene5(1234tetrahydroisoquinolin1yl)pyrimidin4one
6hydroxy13bis(4methoxyphenyl)5(1234tetrahydroisoquinolin1yl)2thioxo23dihydropyrimidin4(1H)one
COC1=CC=C(C=C1)N2C(=C(C(=O)N(C2=S)C3=CC=C(C=C3)OC)C4C5=CC=CC=C5CCN4)O
InChI=1SC27H25N3O4Sc1332011718(81220)2925(31)23(2422643517(22)15162824)26(32)30(27(29)35)1991321(342)141019h314242831H1516H212H3
MFCD04031826
ZINC000013757570
ZINC000020331774
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