2-(4-fluoranylphenoxy)ethyl-methyl-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium

Systemtic Name: 2-(4-fluoranylphenoxy)ethyl-methyl-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium Openeye Name: 2-(4-fluorophenoxy)ethyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]ammonium CAS Name: 2-(4-fluorophenoxy)ethyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]ammonium IUPAC Name: 2-(4-fluorophenoxy)ethyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium Traditional Name: 2-(4-fluorophenoxy)ethyl-[(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+](CCOC1=CC=C(C=C1)F)CC2=NC(=O)C3=C(N2)C=CS3

Isomeric SMILES

C[NH+](CCOC1=CC=C(C=C1)F)CC2=NC(=O)C3=C(N2)C=CS3

InChI

InChI=1S/C16H16FN3O2S/c1-20(7-8-22-12-4-2-11(17)3-5-12)10-14-18-13-6-9-23-15(13)16(21)19-14/h2-6,9H,7-8,10H2,1H3,(H,18,19,21)/p+1