2-[[cycloheptyl(methyl)amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[cycloheptyl(methyl)amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[cycloheptyl(methyl)amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[cycloheptyl(methyl)amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[cycloheptyl(methyl)amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[cycloheptyl(methyl)amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1)C4CCCCCC4

Isomeric SMILES

CN(CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1)C4CCCCCC4

InChI

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