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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2C)C

Isomeric SMILES

CC1=CC(=CC(=C1)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2C)C

InChI

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