3-[[[5-(4-fluorophenyl)thiophen-2-yl]carbonylamino]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[[5-(4-fluorophenyl)thiophen-2-yl]carbonylamino]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[[[5-(4-fluorophenyl)-2-thiophenyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C17H22FN4OS2+ MolecularWeight: 381.511183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21FN4OS2/c1-22(2)11-3-10-19-17(24)21-20-16(23)15-9-8-14(25-15)12-4-6-13(18)7-5-12/h4-9H,3,10-11H2,1-2H3,(H,20,23)(H2,19,21,24)/p+1