Vitas-M small molecule compound

8-{[4-(propan-2-yloxy)benzyl]sulfanyl}-5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline

Catalog ID
STK721441
SMILES CCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SCc1ccc(cc1)OC(C)C

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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 C26H29N3OS2 MW 463.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3OS2/c1-4-7-21-19-8-5-6-9-20(19)22-23-24(32-25(22)29-21)26(28-15-27-23)31-14-17-10-12-18(13-11-17)30-16(2)3/h10-13,15-16H,4-9,14H2,1-3H3
InChIKey
UFJQFRGNSFRGAT-UHFFFAOYSA-N
Synonyms
489443-55-2
489443552
8((4(propan2yloxy)benzyl)sulfanyl)5propyl1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
8((4isopropoxybenzyl)thio)5propyl1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
CCCC1=C2CCCCC2=C3C4=C(C(=NC=N4)SCC5=CC=C(C=C5)OC(C)C)SC3=N1
InChI=1SC26H29N3OS2c1472119856920(19)222324(3225(22)2921)26(28152723)311417101218(131117)3016(2)3h10131516H4914H213H3
MFCD03297364
ZINC000001737868
ZINC01737868
ZINC1737868

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Available files

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