2-[[4-[(4-fluorophenyl)amino]pteridin-2-yl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[4-[(4-fluorophenyl)amino]pteridin-2-yl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[4-(4-fluoroanilino)pteridin-2-yl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[4-(4-fluoroanilino)-2-pteridinyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[4-(4-fluoroanilino)pteridin-2-yl]amino]ethyl-dimethylazanium Traditional Name: 2-[[4-(4-fluoroanilino)pteridin-2-yl]amino]ethyl-dimethyl-ammonium Formula: C16H19FN7+ MolecularWeight: 328.367363

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC1=NC2=NC=CN=C2C(=N1)NC3=CC=C(C=C3)F

Isomeric SMILES

C[NH+](C)CCNC1=NC2=NC=CN=C2C(=N1)NC3=CC=C(C=C3)F

InChI

InChI=1S/C16H18FN7/c1-24(2)10-9-20-16-22-14-13(18-7-8-19-14)15(23-16)21-12-5-3-11(17)4-6-12/h3-8H,9-10H2,1-2H3,(H2,19,20,21,22,23)/p+1