5-(4-bromophenyl)-3-[(5-ethanoyl-2-methoxy-phenyl)methyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-bromophenyl)-3-[(5-ethanoyl-2-methoxy-phenyl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(5-acetyl-2-methoxy-phenyl)methyl]-5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(5-acetyl-2-methoxyphenyl)methyl]-5-(4-bromophenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(5-acetyl-2-methoxyphenyl)methyl]-5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(5-acetyl-2-methoxy-benzyl)-5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H17BrN2O3S MolecularWeight: 469.35098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H17BrN2O3S/c1-13(26)15-5-8-19(28-2)16(9-15)10-25-12-24-21-20(22(25)27)18(11-29-21)14-3-6-17(23)7-4-14/h3-9,11-12H,10H2,1-2H3