Vitas-M small molecule compound
7-tert-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK698862
SMILES O=C(c1ccccc1)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)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 C28H28N2O2S2 MW 488.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O2S2/c1-28(2,3)19-14-15-21-23(16-19)34-25-24(21)26(32)30(20-12-8-5-9-13-20)27(29-25)33-17-22(31)18-10-6-4-7-11-18/h4-13,19H,14-17H2,1-3H3InChIKey
BVPJOROGRFJZAK-UHFFFAOYSA-NSynonyms
351338-57-3351338573
7(tertbutyl)2((2oxo2phenylethyl)thio)3phenyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
7tertbutyl2((2oxo2phenylethyl)sulfanyl)3phenyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7tertbutyl2phenacylsulfanyl3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)C4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC28H28N2O2S2c128(23)1914152123(1619)342524(21)26(32)30(20128591320)27(2925)331722(31)18106471118h41319H1417H213H3
MFCD01878814
ZINC000012650735
ZINC000012650738
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