5,6-dimethyl-2-phenethylsulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-phenethylsulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-phenethylsulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-(phenethylthio)-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-2-phenethylsulfanyl-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-(phenethylthio)-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H20N2OS2 MolecularWeight: 392.537

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCCC3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCCC3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H20N2OS2/c1-15-16(2)27-20-19(15)21(25)24(18-11-7-4-8-12-18)22(23-20)26-14-13-17-9-5-3-6-10-17/h3-12H,13-14H2,1-2H3