Vitas-M small molecule compound

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

Catalog ID
STK532462
SMILES CCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1)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 C23H28N2OS2 MW 412.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2OS2/c1-3-4-5-9-14-27-23-24-21-20(18-13-12-16(2)15-19(18)28-21)22(26)25(23)17-10-7-6-8-11-17/h6-8,10-11,16H,3-5,9,12-15H2,1-2H3
InChIKey
YYLKDCJDWJKQGP-UHFFFAOYSA-N
Synonyms

2(hexylsulfanyl)7methyl3phenyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(hexylthio)7methyl3phenyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2hexylsulfanyl7methyl3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCCCCSC1=NC2=C(C3=C(S2)CC(CC3)C)C(=O)N1C4=CC=CC=C4
InChI=1SC23H28N2OS2c13459142723242120(18131216(2)1519(18)2821)22(26)25(23)17107681117h68101116H3591215H212H3
MFCD02235608
ZINC000002294024
ZINC000002294025

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Available files

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