Vitas-M small molecule compound
ethyl 4-[5-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)furan-2-yl]benzoate
Catalog ID
STK009538
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)c1nc2sc3c(c2c(=O)[nH]1)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 C23H20N2O4S MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O4S/c1-2-28-23(27)14-9-7-13(8-10-14)16-11-12-17(29-16)20-24-21(26)19-15-5-3-4-6-18(15)30-22(19)25-20/h7-12H,2-6H2,1H3,(H,24,25,26)InChIKey
PSRBCVFZJRAUKM-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C3=NC4=C(C5=C(S4)CCCC5)C(=O)N3
CCOC(=O)c1ccc(cc1)c1ccc(o1)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
ethyl4(5(4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)furan2yl)benzoate
ethyl4(5(4oxo5678tetrahydro3H(1)benzothiolo(23d)pyrimidin2yl)furan2yl)benzoate
InChI=1SC23H20N2O4Sc122823(27)149713(81014)16111217(2916)202421(26)1915534618(15)3022(19)2520h712H26H21H3(H242526)
MFCD02297088
STK009538
ZINC000001172151
ZINC01172151
ZINC1172151
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