Vitas-M small molecule compound

3-benzyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one

Catalog ID
STK840674
SMILES CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)Cc1ccccc1)SCC(=O)c1ccccc1)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 C27H26N2O3S2 MW 490.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O3S2/c1-17(2)22-13-20-23(15-32-22)34-25-24(20)26(31)29(14-18-9-5-3-6-10-18)27(28-25)33-16-21(30)19-11-7-4-8-12-19/h3-12,17,22H,13-16H2,1-2H3
InChIKey
TVWOFZJHBKHZMF-UHFFFAOYSA-N
Synonyms
385418-66-6
385418666
3benzyl2((2oxo2phenylethyl)sulfanyl)6(propan2yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
3benzyl2phenacylsulfanyl6propan2yl68dihydro5Hpyrano(23)thieno(24b)pyrimidin4one
3benzyl6isopropyl2((2oxo2phenylethyl)thio)56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC(=O)C4=CC=CC=C4)CC5=CC=CC=C5
InChI=1SC27H26N2O3S2c117(2)22132023(153222)342524(20)26(31)29(141895361018)27(2825)331621(30)19117481219h3121722H1316H212H3
MFCD03286057
ZINC000002320528
ZINC000002320529

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Available files

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