3-[[2-(5-chloranylthiophen-2-yl)quinolin-4-yl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[2-(5-chloranylthiophen-2-yl)quinolin-4-yl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[2-(5-chloro-2-thienyl)quinoline-4-carbonyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[2-(5-chloro-2-thiophenyl)-4-quinolinyl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-(5-chlorothiophen-2-yl)quinoline-4-carbonyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(5-chloro-2-thienyl)quinoline-4-carbonyl]amino]propyl-dimethyl-ammonium Formula: C19H21ClN3OS+ MolecularWeight: 374.90754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(S3)Cl

Isomeric SMILES

C[NH+](C)CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(S3)Cl

InChI

InChI=1S/C19H20ClN3OS/c1-23(2)11-5-10-21-19(24)14-12-16(17-8-9-18(20)25-17)22-15-7-4-3-6-13(14)15/h3-4,6-9,12H,5,10-11H2,1-2H3,(H,21,24)/p+1