Vitas-M small molecule compound

3-(4-methoxyphenyl)-7-methyl-2-(pentylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

Catalog ID
STK531725
SMILES CCCCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCC(C3)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 C23H28N2O2S2 MW 428.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O2S2/c1-4-5-6-13-28-23-24-21-20(18-12-7-15(2)14-19(18)29-21)22(26)25(23)16-8-10-17(27-3)11-9-16/h8-11,15H,4-7,12-14H2,1-3H3
InChIKey
KKBILTCNWDQHBG-UHFFFAOYSA-N
Synonyms

3(4methoxyphenyl)7methyl2(pentylsulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(4methoxyphenyl)7methyl2(pentylthio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3(4methoxyphenyl)7methyl2pentylsulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCCCSC1=NC2=C(C3=C(S2)CC(CC3)C)C(=O)N1C4=CC=C(C=C4)OC
InChI=1SC23H28N2O2S2c1456132823242120(1812715(2)1419(18)2921)22(26)25(23)1681017(273)11916h81115H471214H213H3
MFCD02233676
ZINC000002292059
ZINC000002292060

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Available files

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