6-azanyl-3,5-dicyano-4-(4-fluorophenyl)pyridine-2-thiolate; 4-methylmorpholin-4-ium

Systemtic Name: 6-azanyl-3,5-dicyano-4-(4-fluorophenyl)pyridine-2-thiolate; 4-methylmorpholin-4-ium Openeye Name: 6-amino-3,5-dicyano-4-(4-fluorophenyl)pyridine-2-thiolate; 4-methylmorpholin-4-ium CAS Name: 6-amino-3,5-dicyano-4-(4-fluorophenyl)-2-pyridinethiolate; 4-methylmorpholin-4-ium IUPAC Name: 6-amino-3,5-dicyano-4-(4-fluorophenyl)pyridine-2-thiolate; 4-methylmorpholin-4-ium Traditional Name: 6-amino-3,5-dicyano-4-(4-fluorophenyl)pyridine-2-thiolate; 4-methylmorpholin-4-ium Formula: C18H18FN5OS MolecularWeight: 371.431823

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCOCC1.C1=CC(=CC=C1C2=C(C(=NC(=C2C#N)[S-])N)C#N)F

Isomeric SMILES

C[NH+]1CCOCC1.C1=CC(=CC=C1C2=C(C(=NC(=C2C#N)[S-])N)C#N)F

InChI

InChI=1S/C13H7FN4S.C5H11NO/c14-8-3-1-7(2-4-8)11-9(5-15)12(17)18-13(19)10(11)6-16;1-6-2-4-7-5-3-6/h1-4H,(H3,17,18,19);2-5H2,1H3