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

Systemtic Name: 3-(2,5-dimethylphenyl)-6-phenyl-2-propylsulfanyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-(2,5-dimethylphenyl)-6-phenyl-2-propylsulfanyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 3-(2,5-dimethylphenyl)-6-phenyl-2-(propylthio)-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-(2,5-dimethylphenyl)-6-phenyl-2-propylsulfanylthieno[3,2-d]pyrimidin-4-one Traditional Name: 3-(2,5-dimethylphenyl)-6-phenyl-2-(propylthio)thieno[3,2-d]pyrimidin-4-one Formula: C23H22N2OS2 MolecularWeight: 406.56358

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=C(C(=O)N1C3=C(C=CC(=C3)C)C)SC(=C2)C4=CC=CC=C4

Isomeric SMILES

CCCSC1=NC2=C(C(=O)N1C3=C(C=CC(=C3)C)C)SC(=C2)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2OS2/c1-4-12-27-23-24-18-14-20(17-8-6-5-7-9-17)28-21(18)22(26)25(23)19-13-15(2)10-11-16(19)3/h5-11,13-14H,4,12H2,1-3H3