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

Systemtic Name: 2-[(3-cyanophenyl)carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(3-cyanophenyl)carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[(3-cyanoanilino)-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(3-cyanophenyl)carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[(3-cyanophenyl)thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C12H17N4S+ MolecularWeight: 249.35518

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NC1=CC=CC(=C1)C#N

Isomeric SMILES

C[NH+](C)CCNC(=S)NC1=CC=CC(=C1)C#N

InChI

InChI=1S/C12H16N4S/c1-16(2)7-6-14-12(17)15-11-5-3-4-10(8-11)9-13/h3-5,8H,6-7H2,1-2H3,(H2,14,15,17)/p+1