methyl 2-[3-(2-morpholin-4-ylethyl)-4-oxidanylidene-6-phenyl-thieno[3,2-d]pyrimidin-2-yl]sulfanylpropanoate

Systemtic Name: methyl 2-[3-(2-morpholin-4-ylethyl)-4-oxidanylidene-6-phenyl-thieno[3,2-d]pyrimidin-2-yl]sulfanylpropanoate Openeye Name: methyl 2-[3-(2-morpholinoethyl)-4-oxo-6-phenyl-thieno[3,2-d]pyrimidin-2-yl]sulfanylpropanoate CAS Name: 2-[[3-[2-(4-morpholinyl)ethyl]-4-oxo-6-phenyl-2-thieno[3,2-d]pyrimidinyl]thio]propanoic acid methyl ester IUPAC Name: methyl 2-[3-(2-morpholin-4-ylethyl)-4-oxo-6-phenylthieno[3,2-d]pyrimidin-2-yl]sulfanylpropanoate Traditional Name: 2-[[4-keto-3-(2-morpholinoethyl)-6-phenyl-thieno[3,2-d]pyrimidin-2-yl]thio]propionic acid methyl ester Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SC1=NC2=C(C(=O)N1CCN3CCOCC3)SC(=C2)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)OC)SC1=NC2=C(C(=O)N1CCN3CCOCC3)SC(=C2)C4=CC=CC=C4

InChI

InChI=1S/C22H25N3O4S2/c1-15(21(27)28-2)30-22-23-17-14-18(16-6-4-3-5-7-16)31-19(17)20(26)25(22)9-8-24-10-12-29-13-11-24/h3-7,14-15H,8-13H2,1-2H3