5,6-dimethyl-3-[2-oxidanyl-3-(4-phenoxyphenoxy)propyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-3-[2-oxidanyl-3-(4-phenoxyphenoxy)propyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-hydroxy-3-(4-phenoxyphenoxy)propyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-hydroxy-3-(4-phenoxyphenoxy)propyl]-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-hydroxy-3-(4-phenoxyphenoxy)propyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-hydroxy-3-(4-phenoxyphenoxy)propyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(COC3=CC=C(C=C3)OC4=CC=CC=C4)O)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(COC3=CC=C(C=C3)OC4=CC=CC=C4)O)C

InChI

InChI=1S/C23H22N2O4S/c1-15-16(2)30-22-21(15)23(27)25(14-24-22)12-17(26)13-28-18-8-10-20(11-9-18)29-19-6-4-3-5-7-19/h3-11,14,17,26H,12-13H2,1-2H3