(3-cyano-4,6-dimethyl-2-sulfanylidene-pyridin-1-yl)methyl-cyclopropyl-[(4-fluorophenyl)methyl]azanium

Systemtic Name: (3-cyano-4,6-dimethyl-2-sulfanylidene-pyridin-1-yl)methyl-cyclopropyl-[(4-fluorophenyl)methyl]azanium Openeye Name: (3-cyano-4,6-dimethyl-2-thioxo-1-pyridyl)methyl-cyclopropyl-[(4-fluorophenyl)methyl]ammonium CAS Name: (3-cyano-4,6-dimethyl-2-sulfanylidene-1-pyridinyl)methyl-cyclopropyl-[(4-fluorophenyl)methyl]ammonium IUPAC Name: (3-cyano-4,6-dimethyl-2-sulfanylidenepyridin-1-yl)methyl-cyclopropyl-[(4-fluorophenyl)methyl]azanium Traditional Name: (3-cyano-4,6-dimethyl-2-thioxo-1-pyridyl)methyl-cyclopropyl-(4-fluorobenzyl)ammonium Formula: C19H21FN3S+ MolecularWeight: 342.453543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=S)N1C[NH+](CC2=CC=C(C=C2)F)C3CC3)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=S)N1C[NH+](CC2=CC=C(C=C2)F)C3CC3)C#N)C

InChI

InChI=1S/C19H20FN3S/c1-13-9-14(2)23(19(24)18(13)10-21)12-22(17-7-8-17)11-15-3-5-16(20)6-4-15/h3-6,9,17H,7-8,11-12H2,1-2H3/p+1