2-[[3-ethyl-5-(4-fluorophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]amino]ethylazanium

Systemtic Name: 2-[[3-ethyl-5-(4-fluorophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]amino]ethylazanium Openeye Name: 2-[[3-ethyl-5-(4-fluorophenyl)-4-oxo-thieno[2,3-d]pyrimidin-2-yl]amino]ethylammonium CAS Name: 2-[[3-ethyl-5-(4-fluorophenyl)-4-oxo-2-thieno[2,3-d]pyrimidinyl]amino]ethylammonium IUPAC Name: 2-[[3-ethyl-5-(4-fluorophenyl)-4-oxothieno[2,3-d]pyrimidin-2-yl]amino]ethylazanium Traditional Name: 2-[[3-ethyl-5-(4-fluorophenyl)-4-keto-thieno[2,3-d]pyrimidin-2-yl]amino]ethylammonium Formula: C16H18FN4OS+ MolecularWeight: 333.403723

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1NCC[NH3+])SC=C2C3=CC=C(C=C3)F

Isomeric SMILES

CCN1C(=O)C2=C(N=C1NCC[NH3+])SC=C2C3=CC=C(C=C3)F

InChI

InChI=1S/C16H17FN4OS/c1-2-21-15(22)13-12(10-3-5-11(17)6-4-10)9-23-14(13)20-16(21)19-8-7-18/h3-6,9H,2,7-8,18H2,1H3,(H,19,20)/p+1