2-[[cycloheptyl(methyl)amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[cycloheptyl(methyl)amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[cycloheptyl(methyl)amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[cycloheptyl(methyl)amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[cycloheptyl(methyl)amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[cycloheptyl(methyl)amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H25N3OS MolecularWeight: 367.5077

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N1)C4CCCCCC4

Isomeric SMILES

CN(CC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N1)C4CCCCCC4

InChI

InChI=1S/C21H25N3OS/c1-24(16-11-7-2-3-8-12-16)14-19-22-20(25)17-13-18(26-21(17)23-19)15-9-5-4-6-10-15/h4-6,9-10,13,16H,2-3,7-8,11-12,14H2,1H3,(H,22,23,25)