3-[[2-(4-fluorophenyl)ethanoylamino]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[2-(4-fluorophenyl)ethanoylamino]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[[2-(4-fluorophenyl)acetyl]amino]carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[[2-(4-fluorophenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[[2-(4-fluorophenyl)acetyl]amino]carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[[[2-(4-fluorophenyl)acetyl]amino]thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C14H22FN4OS+ MolecularWeight: 313.414083

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NNC(=O)CC1=CC=C(C=C1)F

Isomeric SMILES

C[NH+](C)CCCNC(=S)NNC(=O)CC1=CC=C(C=C1)F

InChI

InChI=1S/C14H21FN4OS/c1-19(2)9-3-8-16-14(21)18-17-13(20)10-11-4-6-12(15)7-5-11/h4-7H,3,8-10H2,1-2H3,(H,17,20)(H2,16,18,21)/p+1