diethyl-[2-[(4-fluorophenyl)methylcarbamothioyl-(thiophen-2-ylmethyl)amino]ethyl]azanium

Systemtic Name: diethyl-[2-[(4-fluorophenyl)methylcarbamothioyl-(thiophen-2-ylmethyl)amino]ethyl]azanium Openeye Name: diethyl-[2-[(4-fluorophenyl)methylcarbamothioyl-(2-thienylmethyl)amino]ethyl]ammonium CAS Name: diethyl-[2-[[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]-(thiophen-2-ylmethyl)amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(4-fluorophenyl)methylcarbamothioyl-(thiophen-2-ylmethyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[(4-fluorobenzyl)thiocarbamoyl-(2-thenyl)amino]ethyl]ammonium Formula: C19H27FN3S2+ MolecularWeight: 380.566183

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(CC1=CC=CS1)C(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

CC[NH+](CC)CCN(CC1=CC=CS1)C(=S)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C19H26FN3S2/c1-3-22(4-2)11-12-23(15-18-6-5-13-25-18)19(24)21-14-16-7-9-17(20)10-8-16/h5-10,13H,3-4,11-12,14-15H2,1-2H3,(H,21,24)/p+1