2-[[(3-methoxyphenyl)carbamothioylamino]carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(3-methoxyphenyl)carbamothioylamino]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[(3-methoxyphenyl)carbamothioylamino]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[(3-methoxyanilino)-sulfanylidenemethyl]hydrazo]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(3-methoxyphenyl)carbamothioylamino]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[(3-methoxyphenyl)thiocarbamoylamino]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C13H22N5OS2+ MolecularWeight: 328.47668

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NNC(=S)NC1=CC(=CC=C1)OC

Isomeric SMILES

C[NH+](C)CCNC(=S)NNC(=S)NC1=CC(=CC=C1)OC

InChI

InChI=1S/C13H21N5OS2/c1-18(2)8-7-14-12(20)16-17-13(21)15-10-5-4-6-11(9-10)19-3/h4-6,9H,7-8H2,1-3H3,(H2,14,16,20)(H2,15,17,21)/p+1