3-[(2-carbamothioylphenyl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(2-carbamothioylphenyl)amino]propyl-dimethyl-azanium Openeye Name: 3-(2-carbamothioylanilino)propyl-dimethyl-ammonium CAS Name: 3-(2-carbamothioylanilino)propyl-dimethylammonium IUPAC Name: 3-(2-carbamothioylanilino)propyl-dimethylazanium Traditional Name: dimethyl-[3-(2-thiocarbamoylanilino)propyl]ammonium Formula: C12H20N3S+ MolecularWeight: 238.3723

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=CC=CC=C1C(=S)N

Isomeric SMILES

C[NH+](C)CCCNC1=CC=CC=C1C(=S)N

InChI

InChI=1S/C12H19N3S/c1-15(2)9-5-8-14-11-7-4-3-6-10(11)12(13)16/h3-4,6-7,14H,5,8-9H2,1-2H3,(H2,13,16)/p+1