dimethyl-[3-[(2-methylsulfanylphenyl)carbamothioylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[(2-methylsulfanylphenyl)carbamothioylamino]propyl]azanium Openeye Name: dimethyl-[3-[(2-methylsulfanylphenyl)carbamothioylamino]propyl]ammonium CAS Name: dimethyl-[3-[[[2-(methylthio)anilino]-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[(2-methylsulfanylphenyl)carbamothioylamino]propyl]azanium Traditional Name: dimethyl-[3-[[2-(methylthio)phenyl]thiocarbamoylamino]propyl]ammonium Formula: C13H22N3S2+ MolecularWeight: 284.46388

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NC1=CC=CC=C1SC

Isomeric SMILES

C[NH+](C)CCCNC(=S)NC1=CC=CC=C1SC

InChI

InChI=1S/C13H21N3S2/c1-16(2)10-6-9-14-13(17)15-11-7-4-5-8-12(11)18-3/h4-5,7-8H,6,9-10H2,1-3H3,(H2,14,15,17)/p+1