(4-fluorophenyl)methyl-[[5-(4-fluorophenyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methyl-azanium

Systemtic Name: (4-fluorophenyl)methyl-[[5-(4-fluorophenyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methyl-azanium Openeye Name: (4-fluorophenyl)methyl-[[5-(4-fluorophenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methyl-ammonium CAS Name: (4-fluorophenyl)methyl-[[5-(4-fluorophenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methylammonium IUPAC Name: (4-fluorophenyl)methyl-[[5-(4-fluorophenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methylazanium Traditional Name: (4-fluorobenzyl)-[[5-(4-fluorophenyl)-4-keto-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methyl-ammonium Formula: C21H18F2N3OS+ MolecularWeight: 398.448926

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)F)CC2=NC3=C(C(=CS3)C4=CC=C(C=C4)F)C(=O)N2

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)F)CC2=NC3=C(C(=CS3)C4=CC=C(C=C4)F)C(=O)N2

InChI

InChI=1S/C21H17F2N3OS/c1-26(10-13-2-6-15(22)7-3-13)11-18-24-20(27)19-17(12-28-21(19)25-18)14-4-8-16(23)9-5-14/h2-9,12H,10-11H2,1H3,(H,24,25,27)/p+1