Vitas-M small molecule compound
3-(4-methoxyphenyl)-2-methyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK450084
SMILES COc1ccc(cc1)n1c(C)nc2c(c1=O)c1CCCCCc1s2
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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 C19H20N2O2S MW 340.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O2S/c1-12-20-18-17(15-6-4-3-5-7-16(15)24-18)19(22)21(12)13-8-10-14(23-2)11-9-13/h8-11H,3-7H2,1-2H3InChIKey
JKITXDKPGSQEPU-UHFFFAOYSA-NSynonyms
3(4methoxyphenyl)2methyl356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3(4methoxyphenyl)2methyl6789tetrahydro5Hcyclohepta(23)thieno(24d)pyrimidin4one
CC1=NC2=C(C3=C(S2)CCCCC3)C(=O)N1C4=CC=C(C=C4)OC
InChI=1SC19H20N2O2Sc112201817(156435716(15)2418)19(22)21(12)1381014(232)11913h811H37H212H3
MFCD00782631
ZINC000000348247
ZINC00348247
ZINC348247
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