3-[[2-(4-chlorophenyl)sulfanylpyridin-3-yl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[2-(4-chlorophenyl)sulfanylpyridin-3-yl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[2-(4-chlorophenyl)sulfanylpyridine-3-carbonyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[2-[(4-chlorophenyl)thio]-3-pyridinyl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-(4-chlorophenyl)sulfanylpyridine-3-carbonyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-[(4-chlorophenyl)thio]nicotinoyl]amino]propyl-dimethyl-ammonium Formula: C17H21ClN3OS+ MolecularWeight: 350.88614

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C1=C(N=CC=C1)SC2=CC=C(C=C2)Cl

Isomeric SMILES

C[NH+](C)CCCNC(=O)C1=C(N=CC=C1)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H20ClN3OS/c1-21(2)12-4-11-19-16(22)15-5-3-10-20-17(15)23-14-8-6-13(18)7-9-14/h3,5-10H,4,11-12H2,1-2H3,(H,19,22)/p+1