5-(3-chlorophenyl)-2-(piperidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(3-chlorophenyl)-2-(piperidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(3-chlorophenyl)-2-(1-piperidylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(3-chlorophenyl)-2-(1-piperidinylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(3-chlorophenyl)-2-(piperidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(3-chlorophenyl)-2-(piperidinomethyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H18ClN3OS MolecularWeight: 359.87302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=NC3=C(C(=CS3)C4=CC(=CC=C4)Cl)C(=O)N2

Isomeric SMILES

C1CCN(CC1)CC2=NC3=C(C(=CS3)C4=CC(=CC=C4)Cl)C(=O)N2

InChI

InChI=1S/C18H18ClN3OS/c19-13-6-4-5-12(9-13)14-11-24-18-16(14)17(23)20-15(21-18)10-22-7-2-1-3-8-22/h4-6,9,11H,1-3,7-8,10H2,(H,20,21,23)