Vitas-M small molecule compound

7-benzyl-2-(hexylsulfanyl)-3-(4-methylphenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one

Catalog ID
STK926006
SMILES CCCCCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCN(C3)Cc1ccccc1

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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 C29H33N3OS2 MW 503.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N3OS2/c1-3-4-5-9-18-34-29-30-27-26(28(33)32(29)23-14-12-21(2)13-15-23)24-16-17-31(20-25(24)35-27)19-22-10-7-6-8-11-22/h6-8,10-15H,3-5,9,16-20H2,1-2H3
InChIKey
UQYKLRBDSZNMLW-UHFFFAOYSA-N
Synonyms
672893-14-0
672893140
7benzyl2(hexylsulfanyl)3(4methylphenyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl2(hexylthio)3(ptolyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl2hexylsulfanyl3(4methylphenyl)68dihydro5Hpyrido(23)thieno(24b)pyrimidin4one
CCCCCCSC1=NC2=C(C3=C(S2)CN(CC3)CC4=CC=CC=C4)C(=O)N1C5=CC=C(C=C5)C
InChI=1SC29H33N3OS2c13459183429302726(28(33)32(29)23141221(2)131523)24161731(2025(24)3527)1922107681122h681015H3591620H212H3
MFCD03812982
ZINC000020567659
ZINC20567659

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Available files

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