5-(3,4-dimethylphenyl)-3-[(4-methylsulfanylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(3,4-dimethylphenyl)-3-[(4-methylsulfanylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(3,4-dimethylphenyl)-3-[(4-methylsulfanylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(3,4-dimethylphenyl)-3-[[4-(methylthio)phenyl]methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(3,4-dimethylphenyl)-3-[(4-methylsulfanylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(3,4-dimethylphenyl)-3-[4-(methylthio)benzyl]thieno[2,3-d]pyrimidin-4-one Formula: C22H20N2OS2 MolecularWeight: 392.537

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4=CC=C(C=C4)SC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4=CC=C(C=C4)SC)C

InChI

InChI=1S/C22H20N2OS2/c1-14-4-7-17(10-15(14)2)19-12-27-21-20(19)22(25)24(13-23-21)11-16-5-8-18(26-3)9-6-16/h4-10,12-13H,11H2,1-3H3