2-phenacylsulfanyl-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-phenacylsulfanyl-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-isopropylphenyl)-2-phenacylsulfanyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(phenacylthio)-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-phenacylsulfanyl-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-p-cumenyl-2-(phenacylthio)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C23H20N2O2S2 MolecularWeight: 420.5471

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N2O2S2/c1-14(2)15-8-10-16(11-9-15)18-12-28-22-20(18)21(27)24-23(25-22)29-13-19(26)17-6-4-3-5-7-17/h3-12,14H,13H2,1-2H3,(H,24,25,27)