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

Systemtic Name: 3-[(2S)-3-(3-bromanylphenoxy)-2-oxidanyl-propyl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-[(2S)-3-(3-bromophenoxy)-2-hydroxy-propyl]thieno[3,2-d]pyrimidin-4-one CAS Name: 3-[(2S)-3-(3-bromophenoxy)-2-hydroxypropyl]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-[(2S)-3-(3-bromophenoxy)-2-hydroxypropyl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-[(2S)-3-(3-bromophenoxy)-2-hydroxy-propyl]thieno[3,2-d]pyrimidin-4-one Formula: C15H13BrN2O3S MolecularWeight: 381.24432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)OCC(CN2C=NC3=C(C2=O)SC=C3)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)OC[C@H](CN2C=NC3=C(C2=O)SC=C3)O

InChI

InChI=1S/C15H13BrN2O3S/c16-10-2-1-3-12(6-10)21-8-11(19)7-18-9-17-13-4-5-22-14(13)15(18)20/h1-6,9,11,19H,7-8H2/t11-/m0/s1