3-[3-(3-bromanylphenoxy)-2-oxidanyl-propyl]-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[3-(3-bromanylphenoxy)-2-oxidanyl-propyl]-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[3-(3-bromophenoxy)-2-hydroxy-propyl]-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[3-(3-bromophenoxy)-2-hydroxypropyl]-5-(4-methoxyphenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[3-(3-bromophenoxy)-2-hydroxypropyl]-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[3-(3-bromophenoxy)-2-hydroxy-propyl]-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H19BrN2O4S MolecularWeight: 487.36626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(COC4=CC(=CC=C4)Br)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(COC4=CC(=CC=C4)Br)O

InChI

InChI=1S/C22H19BrN2O4S/c1-28-17-7-5-14(6-8-17)19-12-30-21-20(19)22(27)25(13-24-21)10-16(26)11-29-18-4-2-3-15(23)9-18/h2-9,12-13,16,26H,10-11H2,1H3