2-(2-azanyl-4-chloranyl-phenyl)sulfanylethyl-diethyl-azanium

Systemtic Name: 2-(2-azanyl-4-chloranyl-phenyl)sulfanylethyl-diethyl-azanium Openeye Name: 2-(2-amino-4-chloro-phenyl)sulfanylethyl-diethyl-ammonium CAS Name: 2-[(2-amino-4-chlorophenyl)thio]ethyl-diethylammonium IUPAC Name: 2-(2-amino-4-chlorophenyl)sulfanylethyl-diethylazanium Traditional Name: 2-[(2-amino-4-chloro-phenyl)thio]ethyl-diethyl-ammonium Formula: C12H20ClN2S+ MolecularWeight: 259.8186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCSC1=C(C=C(C=C1)Cl)N

Isomeric SMILES

CC[NH+](CC)CCSC1=C(C=C(C=C1)Cl)N

InChI

InChI=1S/C12H19ClN2S/c1-3-15(4-2)7-8-16-12-6-5-10(13)9-11(12)14/h5-6,9H,3-4,7-8,14H2,1-2H3/p+1