2-[[[5-(4-fluorophenyl)thiophen-2-yl]carbonylamino]carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[[5-(4-fluorophenyl)thiophen-2-yl]carbonylamino]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[[5-(4-fluorophenyl)-2-thiophenyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C16H20FN4OS2+ MolecularWeight: 367.484603

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NNC(=O)C1=CC=C(S1)C2=CC=C(C=C2)F

Isomeric SMILES

C[NH+](C)CCNC(=S)NNC(=O)C1=CC=C(S1)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H19FN4OS2/c1-21(2)10-9-18-16(23)20-19-15(22)14-8-7-13(24-14)11-3-5-12(17)6-4-11/h3-8H,9-10H2,1-2H3,(H,19,22)(H2,18,20,23)/p+1