2-(3-phenoxypropylsulfanyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(3-phenoxypropylsulfanyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(3-phenoxypropylsulfanyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(3-phenoxypropylthio)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(3-phenoxypropylsulfanyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(3-phenoxypropylthio)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H18N2O2S2 MolecularWeight: 394.50982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)SCCCOC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)SCCCOC4=CC=CC=C4

InChI

InChI=1S/C21H18N2O2S2/c24-19-18-17(15-8-3-1-4-9-15)14-27-20(18)23-21(22-19)26-13-7-12-25-16-10-5-2-6-11-16/h1-6,8-11,14H,7,12-13H2,(H,22,23,24)