2-(chloromethyl)-5-phenyl-6-propan-2-yl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(chloromethyl)-5-phenyl-6-propan-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(chloromethyl)-6-isopropyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(chloromethyl)-5-phenyl-6-propan-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(chloromethyl)-5-phenyl-6-propan-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(chloromethyl)-6-isopropyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C16H15ClN2OS MolecularWeight: 318.8211

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C2=C(S1)N=C(NC2=O)CCl)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(C2=C(S1)N=C(NC2=O)CCl)C3=CC=CC=C3

InChI

InChI=1S/C16H15ClN2OS/c1-9(2)14-12(10-6-4-3-5-7-10)13-15(20)18-11(8-17)19-16(13)21-14/h3-7,9H,8H2,1-2H3,(H,18,19,20)