Vitas-M small molecule compound

2-(hexylsulfanyl)-3-(4-methoxyphenyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one

Catalog ID
STK722346
SMILES CCCCCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCCCC3

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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 C24H30N2O2S2 MW 442.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N2O2S2/c1-3-4-5-9-16-29-24-25-22-21(19-10-7-6-8-11-20(19)30-22)23(27)26(24)17-12-14-18(28-2)15-13-17/h12-15H,3-11,16H2,1-2H3
InChIKey
NWFUPLYCKZLMMY-UHFFFAOYSA-N
Synonyms
351160-25-3
2(hexylsulfanyl)3(4methoxyphenyl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
2(hexylthio)3(4methoxyphenyl)6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
2hexylsulfanyl3(4methoxyphenyl)6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
351160253
CCCCCCSC1=NC2=C(C3=C(S2)CCCCC3)C(=O)N1C4=CC=C(C=C4)OC
InChI=1SC24H30N2O2S2c13459162924252221(19107681120(19)3022)23(27)26(24)17121418(282)151317h1215H31116H212H3
MFCD01880775
ZINC000002276061
ZINC02276061
ZINC2276061

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Available files

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