Vitas-M small molecule compound

2-(hexylsulfanyl)-3-(3-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one

Catalog ID
STK721070
SMILES CCCCCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

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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 C25H32N2O2S2 MW 456.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N2O2S2/c1-5-6-7-8-12-30-25-26-23-22(19-14-20(16(2)3)29-15-21(19)31-23)24(28)27(25)18-11-9-10-17(4)13-18/h9-11,13,16,20H,5-8,12,14-15H2,1-4H3
InChIKey
PFTSMSJNWGLFPR-UHFFFAOYSA-N
Synonyms
385419-34-1
2(hexylsulfanyl)3(3methylphenyl)6(propan2yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
2(hexylthio)6isopropyl3(mtolyl)56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
2hexylsulfanyl3(3methylphenyl)6propan2yl68dihydro5Hpyrano(23)thieno(24b)pyrimidin4one
385419341
CCCCCCSC1=NC2=C(C3=C(S2)COC(C3)C(C)C)C(=O)N1C4=CC=CC(=C4)C
InChI=1SC25H32N2O2S2c15678123025262322(191420(16(2)3)291521(19)3123)24(28)27(25)181191017(4)1318h911131620H58121415H214H3
MFCD03286091
ZINC000002320553
ZINC000002320554

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Available files

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