3-(2,5-dimethylphenyl)-5-ethyl-6-methyl-2-[2-[(2S)-2-methylmorpholin-4-yl]-2-oxidanylidene-ethyl]sulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(2,5-dimethylphenyl)-5-ethyl-6-methyl-2-[2-[(2S)-2-methylmorpholin-4-yl]-2-oxidanylidene-ethyl]sulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(2,5-dimethylphenyl)-5-ethyl-6-methyl-2-[2-[(2S)-2-methylmorpholin-4-yl]-2-oxo-ethyl]sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(2,5-dimethylphenyl)-5-ethyl-6-methyl-2-[[2-[(2S)-2-methyl-4-morpholinyl]-2-oxoethyl]thio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(2,5-dimethylphenyl)-5-ethyl-6-methyl-2-[2-[(2S)-2-methylmorpholin-4-yl]-2-oxoethyl]sulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(2,5-dimethylphenyl)-5-ethyl-2-[[2-keto-2-[(2S)-2-methylmorpholino]ethyl]thio]-6-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C24H29N3O3S2 MolecularWeight: 471.63536

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)N3CCOC(C3)C)C4=C(C=CC(=C4)C)C)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)N3CCO[C@H](C3)C)C4=C(C=CC(=C4)C)C)C

InChI

InChI=1S/C24H29N3O3S2/c1-6-18-17(5)32-22-21(18)23(29)27(19-11-14(2)7-8-15(19)3)24(25-22)31-13-20(28)26-9-10-30-16(4)12-26/h7-8,11,16H,6,9-10,12-13H2,1-5H3/t16-/m0/s1