Vitas-M small molecule compound
3-benzyl-7-tert-butyl-2-(butylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK722462
SMILES CCCCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCC(C3)C(C)(C)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 C25H32N2OS2 MW 440.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N2OS2/c1-5-6-14-29-24-26-22-21(23(28)27(24)16-17-10-8-7-9-11-17)19-13-12-18(25(2,3)4)15-20(19)30-22/h7-11,18H,5-6,12-16H2,1-4H3InChIKey
GISGDUUHFDHJLQ-UHFFFAOYSA-NSynonyms
351338-35-7351338357
3benzyl7(tertbutyl)2(butylthio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3benzyl7tertbutyl2(butylsulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3benzyl7tertbutyl2butylsulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCCSC1=NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)N1CC4=CC=CC=C4
InChI=1SC25H32N2OS2c156142924262221(23(28)27(24)1617108791117)19131218(25(23)4)1520(19)3022h71118H561216H214H3
MFCD01878089
ZINC000002320128
ZINC000002320129
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