Vitas-M small molecule compound
3-(cyclohexylmethyl)-2-(propylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK721954
SMILES CCCSc1nc2sc3c(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 C20H28N2OS2 MW 376.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N2OS2/c1-2-12-24-20-21-18-17(15-10-6-7-11-16(15)25-18)19(23)22(20)13-14-8-4-3-5-9-14/h14H,2-13H2,1H3InChIKey
NLRNAIOBTQQFBN-UHFFFAOYSA-NSynonyms
3(cyclohexylmethyl)2(propylsulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(cyclohexylmethyl)2(propylthio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3(cyclohexylmethyl)2propylsulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1CC4CCCCC4
InChI=1SC20H28N2OS2c12122420211817(1510671116(15)2518)19(23)22(20)13148435914h14H213H21H3
MFCD01902213
ZINC000002294132
ZINC02294132
ZINC2294132
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