(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl-methyl-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]ammonium CAS Name: (3-fluoro-4-methoxyphenyl)methyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]ammonium IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium Traditional Name: (3-fluoro-4-methoxy-benzyl)-[(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-methyl-ammonium Formula: C16H17FN3O2S+ MolecularWeight: 334.388483

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=C(C=C1)OC)F)CC2=NC(=O)C3=C(N2)C=CS3

Isomeric SMILES

C[NH+](CC1=CC(=C(C=C1)OC)F)CC2=NC(=O)C3=C(N2)C=CS3

InChI

InChI=1S/C16H16FN3O2S/c1-20(8-10-3-4-13(22-2)11(17)7-10)9-14-18-12-5-6-23-15(12)16(21)19-14/h3-7H,8-9H2,1-2H3,(H,18,19,21)/p+1