2-azanyl-6-[(3-fluorophenyl)methylsulfanyl]-4-thiophen-2-yl-pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-[(3-fluorophenyl)methylsulfanyl]-4-thiophen-2-yl-pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-6-[(3-fluorophenyl)methylsulfanyl]-4-(2-thienyl)pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-6-[(3-fluorophenyl)methylthio]-4-thiophen-2-ylpyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[(3-fluorophenyl)methylsulfanyl]-4-thiophen-2-ylpyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-6-[(3-fluorobenzyl)thio]-4-(2-thienyl)pyridin-1-ium-3,5-dicarbonitrile Formula: C18H12FN4S2+ MolecularWeight: 367.443083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CSC2=C(C(=C(C(=[NH+]2)N)C#N)C3=CC=CS3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)F)CSC2=C(C(=C(C(=[NH+]2)N)C#N)C3=CC=CS3)C#N

InChI

InChI=1S/C18H11FN4S2/c19-12-4-1-3-11(7-12)10-25-18-14(9-21)16(15-5-2-6-24-15)13(8-20)17(22)23-18/h1-7H,10H2,(H2,22,23)/p+1