Vitas-M small molecule compound

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

Catalog ID
STK045598
SMILES CCCCCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCCC3

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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 C22H26N2OS2 MW 398.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2OS2/c1-2-3-9-14-26-22-23-20-19(17-12-7-8-13-18(17)27-20)21(25)24(22)15-16-10-5-4-6-11-16/h4-6,10-11H,2-3,7-9,12-15H2,1H3
InChIKey
SJCFZNCOMUGNJJ-UHFFFAOYSA-N
Synonyms
353762-73-9
353762739
3benzyl2(pentylsulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3benzyl2(pentylthio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3benzyl2pentylsulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCCCSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1CC4=CC=CC=C4
CCCCCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCCC3
InChI=1SC22H26N2OS2c1239142622232019(1712781318(17)2720)21(25)24(22)1516105461116h461011H23791215H21H3
MFCD01557300
STK045598
ZINC000002181971
ZINC02181971
ZINC2181971

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Available files

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