Vitas-M small molecule compound
3-cyclohexyl-6-hydroxy-2-sulfanyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)pyrimidin-4(3H)-one
Catalog ID
STL528429
SMILES Oc1nc(S)n(c(=O)c1C1NCCc2c1[nH]c1c2cccc1)C1CCCCC1
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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 C21H24N4O2S MW 396.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O2S/c26-19-16(20(27)25(21(28)24-19)12-6-2-1-3-7-12)18-17-14(10-11-22-18)13-8-4-5-9-15(13)23-17/h4-5,8-9,12,18,22-23,26H,1-3,6-7,10-11H2,(H,24,28)InChIKey
UOFAJPGULOPCKI-UHFFFAOYSA-NSynonyms
3cyclohexyl6hydroxy2sulfanyl5(2349tetrahydro1Hbetacarbolin1yl)pyrimidin4(3H)one
InChI=1SC21H24N4O2Sc261916(20(27)25(21(28)2419)126213712)181714(10112218)13845915(13)2317h45891218222326H13671011H2(H2428)
MFCD04071756
ZINC000017180926
ZINC000017180928
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