Vitas-M small molecule compound
2-(butylsulfanyl)-3-(2-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK531730
SMILES CCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)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 C21H24N2OS2 MW 384.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2OS2/c1-3-4-13-25-21-22-19-18(15-10-6-8-12-17(15)26-19)20(24)23(21)16-11-7-5-9-14(16)2/h5,7,9,11H,3-4,6,8,10,12-13H2,1-2H3InChIKey
GPBCTQQKFSVPNH-UHFFFAOYSA-NSynonyms
2(butylsulfanyl)3(2methylphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(butylthio)3(otolyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2butylsulfanyl3(2methylphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCCSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=CC=C4C
InChI=1SC21H24N2OS2c134132521221918(1510681217(15)2619)20(24)23(21)161175914(16)2h57911H3468101213H212H3
MFCD02992897
ZINC000001830863
ZINC01830863
ZINC1830863
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