Vitas-M small molecule compound
9-methyl-8-({[2-methyl-5-(4-propoxyphenyl)furan-3-yl]methyl}sulfanyl)-1,9-dihydro-6H-purin-6-one
Catalog ID
STK497043
SMILES CCCOc1ccc(cc1)c1cc(c(o1)C)CSc1nc2c(n1C)nc[nH]c2=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 C21H22N4O3S MW 410.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3S/c1-4-9-27-16-7-5-14(6-8-16)17-10-15(13(2)28-17)11-29-21-24-18-19(25(21)3)22-12-23-20(18)26/h5-8,10,12H,4,9,11H2,1-3H3,(H,22,23,26)InChIKey
XGEICNUIZGEUAN-UHFFFAOYSA-NSynonyms
9methyl8(((2methyl5(4propoxyphenyl)furan3yl)methyl)sulfanyl)19dihydro6Hpurin6one
9METHYL8((2METHYL5(4PROPOXYPHENYL)(3FURYL))METHYLTHIO)HYDROPURIN6ONE
9methyl8((2methyl5(4propoxyphenyl)furan3yl)methylsulfanyl)3Hpurin6one
CCCOC1=CC=C(C=C1)C2=CC(=C(O2)C)CSC3=NC4=C(N3C)NC=NC4=O
CCCOc1ccc(cc1)c1cc(c(o1)C)CSc1nc2c(n1C)nc(nH)c2=O
InChI=1SC21H22N4O3Sc14927167514(6816)171015(13(2)2817)112921241819(25(21)3)22122320(18)26h581012H4911H213H3(H222326)
MFCD09788440
ZINC000012411349
ZINC12411349
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