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

Systemtic Name: 3-[(2-chlorophenyl)carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[(2-chlorophenyl)carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[(2-chloroanilino)-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(2-chlorophenyl)carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[(2-chlorophenyl)thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C12H19ClN3S+ MolecularWeight: 272.81736

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NC1=CC=CC=C1Cl

Isomeric SMILES

C[NH+](C)CCCNC(=S)NC1=CC=CC=C1Cl

InChI

InChI=1S/C12H18ClN3S/c1-16(2)9-5-8-14-12(17)15-11-7-4-3-6-10(11)13/h3-4,6-7H,5,8-9H2,1-2H3,(H2,14,15,17)/p+1