(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 2-(4-phenylphenyl)ethanoate

Systemtic Name: (4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 2-(4-phenylphenyl)ethanoate Openeye Name: (4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 2-(4-phenylphenyl)acetate CAS Name: 2-(4-phenylphenyl)acetic acid (4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 2-(4-phenylphenyl)acetate Traditional Name: 2-(4-phenylphenyl)acetic acid (4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl ester Formula: C27H20N2O3S MolecularWeight: 452.5243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)OCC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)OCC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3

InChI

InChI=1S/C27H20N2O3S/c30-24(15-18-11-13-20(14-12-18)19-7-3-1-4-8-19)32-16-23-28-26(31)25-22(17-33-27(25)29-23)21-9-5-2-6-10-21/h1-14,17H,15-16H2,(H,28,29,31)