2-[[1-(3-chlorophenyl)ethylamino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[1-(3-chlorophenyl)ethylamino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[1-(3-chlorophenyl)ethylamino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[1-(3-chlorophenyl)ethylamino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[1-(3-chlorophenyl)ethylamino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[1-(3-chlorophenyl)ethylamino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H18ClN3OS MolecularWeight: 395.90512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Cl)NCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CC(C1=CC(=CC=C1)Cl)NCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C21H18ClN3OS/c1-13(15-8-5-9-16(22)10-15)23-11-18-24-20(26)19-17(12-27-21(19)25-18)14-6-3-2-4-7-14/h2-10,12-13,23H,11H2,1H3,(H,24,25,26)