3-[(2S)-2-oxidanyl-3-(4-phenylphenoxy)propyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(2S)-2-oxidanyl-3-(4-phenylphenoxy)propyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]thieno[2,3-d]pyrimidin-4-one Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)OCC(CN3C=NC4=C(C3=O)C=CS4)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)OC[C@H](CN3C=NC4=C(C3=O)C=CS4)O

InChI

InChI=1S/C21H18N2O3S/c24-17(12-23-14-22-20-19(21(23)25)10-11-27-20)13-26-18-8-6-16(7-9-18)15-4-2-1-3-5-15/h1-11,14,17,24H,12-13H2/t17-/m0/s1