Vitas-M small molecule compound
2-(heptylsulfanyl)-6,6-dimethyl-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK083671
SMILES C=CCn1c(SCCCCCCC)nc2c(c1=O)c1CC(C)(C)OCc1s2
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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 C21H30N2O2S2 MW 406.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N2O2S2/c1-5-7-8-9-10-12-26-20-22-18-17(19(24)23(20)11-6-2)15-13-21(3,4)25-14-16(15)27-18/h6H,2,5,7-14H2,1,3-4H3InChIKey
OMTXCISLDSQNMA-UHFFFAOYSA-NSynonyms
368889-74-12(heptylsulfanyl)66dimethyl3(prop2en1yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
2heptylsulfanyl66dimethyl3prop2enyl58dihydropyrano(23)thieno(24b)pyrimidin4one
368889741
3allyl2(heptylthio)66dimethyl56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
C=CCn1c(SCCCCCCC)nc2c(c1=O)c1CC(C)(C)OCc1s2
CCCCCCCSC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1CC=C
InChI=1SC21H30N2O2S2c1578910122620221817(19(24)23(20)1162)151321(34)251416(15)2718h6H25714H2134H3
MFCD01557705
STK083671
ZINC000002196786
ZINC2196786
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