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

Systemtic Name: 3-[[2-[(4-methoxyphenyl)amino]ethanoylamino]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[[2-(4-methoxyanilino)acetyl]amino]carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[[2-(4-methoxyanilino)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[[2-(4-methoxyanilino)acetyl]amino]carbamothioylamino]propyl-dimethylazanium Traditional Name: dimethyl-[3-[[[2-(p-anisidino)acetyl]amino]thiocarbamoylamino]propyl]ammonium Formula: C15H26N5O2S+ MolecularWeight: 340.46424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NNC(=O)CNC1=CC=C(C=C1)OC

Isomeric SMILES

C[NH+](C)CCCNC(=S)NNC(=O)CNC1=CC=C(C=C1)OC

InChI

InChI=1S/C15H25N5O2S/c1-20(2)10-4-9-16-15(23)19-18-14(21)11-17-12-5-7-13(22-3)8-6-12/h5-8,17H,4,9-11H2,1-3H3,(H,18,21)(H2,16,19,23)/p+1