Vitas-M small molecule compound
4-butyl-7-[(4-chlorobenzyl)sulfanyl]-2,3,5a,10b-tetrahydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Catalog ID
STK551550
SMILES CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncnc3SCc1ccc(cc1)Cl
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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 C23H24ClN3S2 MW 442.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24ClN3S2/c1-2-3-7-18-16-5-4-6-17(16)19-20-21(29-22(19)27-18)23(26-13-25-20)28-12-14-8-10-15(24)11-9-14/h8-11,13,19,22H,2-7,12H2,1H3InChIKey
VXPUVNNOJLOVOH-UHFFFAOYSA-NSynonyms
4butyl7((4chlorobenzyl)sulfanyl)235a10btetrahydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidine
CCCCC1=NC2C(C3=C1CCC3)C4=C(S2)C(=NC=N4)SCC5=CC=C(C=C5)Cl
InChI=1SC23H24ClN3S2c1237181654617(16)192021(2922(19)2718)23(26132520)28121481015(24)11914h811131922H2712H21H3
MFCD03679553
ZINC000026464326
ZINC000026464345
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