3-(azanylcarbamothioylamino)propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-(azanylcarbamothioylamino)propyl-methyl-(phenylmethyl)azanium Openeye Name: 3-(aminocarbamothioylamino)propyl-benzyl-methyl-ammonium CAS Name: 3-[[hydrazinyl(sulfanylidene)methyl]amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: 3-(aminocarbamothioylamino)propyl-benzyl-methylazanium Traditional Name: 3-(aminothiocarbamoylamino)propyl-benzyl-methyl-ammonium Formula: C12H21N4S+ MolecularWeight: 253.38694

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=S)NN)CC1=CC=CC=C1

Isomeric SMILES

C[NH+](CCCNC(=S)NN)CC1=CC=CC=C1

InChI

InChI=1S/C12H20N4S/c1-16(9-5-8-14-12(17)15-13)10-11-6-3-2-4-7-11/h2-4,6-7H,5,8-10,13H2,1H3,(H2,14,15,17)/p+1