Vitas-M small molecule compound
ethyl 2-(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)butanoate
Catalog ID
STL331933
SMILES CCOC(=O)C(n1cnc2c(c1=O)c1CCC(Cc1s2)C)CC
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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 C17H22N2O3S MW 334.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O3S/c1-4-12(17(21)22-5-2)19-9-18-15-14(16(19)20)11-7-6-10(3)8-13(11)23-15/h9-10,12H,4-8H2,1-3H3InChIKey
FTZJVPYHVXJDBS-UHFFFAOYSA-NSynonyms
369397-89-7369397897
CCC(C(=O)OCC)N1C=NC2=C(C1=O)C3=C(S2)CC(CC3)C
ethyl2(7methyl4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)butanoate
ethyl2(7methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)butanoate
ethyl2(7methyl4oxo5678tetrahydrobenzo(45)thieno(23d)pyrimidin3(4H)yl)butanoate
InChI=1SC17H22N2O3Sc1412(17(21)2252)199181514(16(19)20)117610(3)813(11)2315h91012H48H213H3
MFCD02656344
ZINC000000305554
ZINC000004042593
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