Vitas-M small molecule compound
2-(butylsulfanyl)-7-methyl-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK531247
SMILES CCCCSc1nc2sc3c(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 C21H24N2OS2 MW 384.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2OS2/c1-3-4-12-25-21-22-19-18(16-11-10-14(2)13-17(16)26-19)20(24)23(21)15-8-6-5-7-9-15/h5-9,14H,3-4,10-13H2,1-2H3InChIKey
XYOXIHSFFVCDMN-UHFFFAOYSA-NSynonyms
2(butylsulfanyl)7methyl3phenyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(butylthio)7methyl3phenyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2butylsulfanyl7methyl3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCCSC1=NC2=C(C3=C(S2)CC(CC3)C)C(=O)N1C4=CC=CC=C4
InChI=1SC21H24N2OS2c134122521221918(16111014(2)1317(16)2619)20(24)23(21)158657915h5914H341013H212H3
MFCD02237853
ZINC000002295992
ZINC000002295993
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