3-[[(4-ethoxyphenyl)carbamothioylamino]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(4-ethoxyphenyl)carbamothioylamino]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[(4-ethoxyphenyl)carbamothioylamino]carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[[(4-ethoxyanilino)-sulfanylidenemethyl]hydrazo]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(4-ethoxyphenyl)carbamothioylamino]carbamothioylamino]propyl-dimethylazanium Traditional Name: dimethyl-[3-[(p-phenetylthiocarbamoylamino)thiocarbamoylamino]propyl]ammonium Formula: C15H26N5OS2+ MolecularWeight: 356.52984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NNC(=S)NCCC[NH+](C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NNC(=S)NCCC[NH+](C)C

InChI

InChI=1S/C15H25N5OS2/c1-4-21-13-8-6-12(7-9-13)17-15(23)19-18-14(22)16-10-5-11-20(2)3/h6-9H,4-5,10-11H2,1-3H3,(H2,16,18,22)(H2,17,19,23)/p+1