5-phenyl-3-[(5-phenyl-1,2-oxazol-3-yl)methyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-phenyl-3-[(5-phenyl-1,2-oxazol-3-yl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-phenyl-3-[(5-phenylisoxazol-3-yl)methyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5-phenyl-3-[(5-phenyl-3-isoxazolyl)methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-phenyl-3-[(5-phenyl-1,2-oxazol-3-yl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-phenyl-3-[(5-phenylisoxazol-3-yl)methyl]thieno[2,3-d]pyrimidin-4-one Formula: C22H15N3O2S MolecularWeight: 385.4384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)CN3C=NC4=C(C3=O)C(=CS4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)CN3C=NC4=C(C3=O)C(=CS4)C5=CC=CC=C5

InChI

InChI=1S/C22H15N3O2S/c26-22-20-18(15-7-3-1-4-8-15)13-28-21(20)23-14-25(22)12-17-11-19(27-24-17)16-9-5-2-6-10-16/h1-11,13-14H,12H2