2-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[(2-chloro-6-fluoro-phenyl)methyl-methyl-amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(2-chloro-6-fluorophenyl)methyl-methylamino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[(2-chloro-6-fluorophenyl)methyl-methylamino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(2-chloro-6-fluoro-benzyl)-methyl-amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H17ClFN3OS MolecularWeight: 413.895583

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC=C1Cl)F)CC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CN(CC1=C(C=CC=C1Cl)F)CC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C21H17ClFN3OS/c1-26(10-14-16(22)8-5-9-17(14)23)11-18-24-20(27)19-15(12-28-21(19)25-18)13-6-3-2-4-7-13/h2-9,12H,10-11H2,1H3,(H,24,25,27)