5-(4-methylphenyl)-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-methylphenyl)-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-methylphenyl)-2-[[2-oxo-2-(4-phenylphenyl)ethyl]thio]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-methylphenyl)-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-keto-2-(4-phenylphenyl)ethyl]thio]-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C27H20N2O2S2 MolecularWeight: 468.5899

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)SCC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)SCC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H20N2O2S2/c1-17-7-9-20(10-8-17)22-15-32-26-24(22)25(31)28-27(29-26)33-16-23(30)21-13-11-19(12-14-21)18-5-3-2-4-6-18/h2-15H,16H2,1H3,(H,28,29,31)