3-[3-[(3,4-dichlorophenyl)methylsulfanyl]propanoylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[3-[(3,4-dichlorophenyl)methylsulfanyl]propanoylamino]propyl-dimethyl-azanium Openeye Name: 3-[3-[(3,4-dichlorophenyl)methylsulfanyl]propanoylamino]propyl-dimethyl-ammonium CAS Name: 3-[[3-[(3,4-dichlorophenyl)methylthio]-1-oxopropyl]amino]propyl-dimethylammonium IUPAC Name: 3-[3-[(3,4-dichlorophenyl)methylsulfanyl]propanoylamino]propyl-dimethylazanium Traditional Name: 3-[3-[(3,4-dichlorobenzyl)thio]propanoylamino]propyl-dimethyl-ammonium Formula: C15H23Cl2N2OS+ MolecularWeight: 350.32692

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)CCSCC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

C[NH+](C)CCCNC(=O)CCSCC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C15H22Cl2N2OS/c1-19(2)8-3-7-18-15(20)6-9-21-11-12-4-5-13(16)14(17)10-12/h4-5,10H,3,6-9,11H2,1-2H3,(H,18,20)/p+1