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

Systemtic Name: 3-[2-oxidanyl-3-(2,3,6-trimethylphenoxy)propyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C24H24N2O3S MolecularWeight: 420.52396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCC(CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCC(CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4)O)C

InChI

InChI=1S/C24H24N2O3S/c1-15-9-10-16(2)22(17(15)3)29-12-19(27)11-26-14-25-23-21(24(26)28)20(13-30-23)18-7-5-4-6-8-18/h4-10,13-14,19,27H,11-12H2,1-3H3