3-(2,5-dimethylphenyl)-2-(2-phenoxyethylsulfanyl)-6-phenyl-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(2,5-dimethylphenyl)-2-(2-phenoxyethylsulfanyl)-6-phenyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-(2,5-dimethylphenyl)-2-(2-phenoxyethylsulfanyl)-6-phenyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 3-(2,5-dimethylphenyl)-2-(2-phenoxyethylthio)-6-phenyl-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-(2,5-dimethylphenyl)-2-(2-phenoxyethylsulfanyl)-6-phenylthieno[3,2-d]pyrimidin-4-one Traditional Name: 3-(2,5-dimethylphenyl)-2-(2-phenoxyethylthio)-6-phenyl-thieno[3,2-d]pyrimidin-4-one Formula: C28H24N2O2S2 MolecularWeight: 484.63236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)C3=C(C=C(S3)C4=CC=CC=C4)N=C2SCCOC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)C3=C(C=C(S3)C4=CC=CC=C4)N=C2SCCOC5=CC=CC=C5

InChI

InChI=1S/C28H24N2O2S2/c1-19-13-14-20(2)24(17-19)30-27(31)26-23(18-25(34-26)21-9-5-3-6-10-21)29-28(30)33-16-15-32-22-11-7-4-8-12-22/h3-14,17-18H,15-16H2,1-2H3