2-[[2-(3,4-dichlorophenyl)-5-thiophen-2-yl-pyrazol-3-yl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[2-(3,4-dichlorophenyl)-5-thiophen-2-yl-pyrazol-3-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-(3,4-dichlorophenyl)-5-(2-thienyl)pyrazole-3-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[2-(3,4-dichlorophenyl)-5-thiophen-2-yl-3-pyrazolyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-(3,4-dichlorophenyl)-5-thiophen-2-ylpyrazole-3-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[2-(3,4-dichlorophenyl)-5-(2-thienyl)pyrazole-3-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C18H19Cl2N4OS+ MolecularWeight: 410.34066

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=CC(=NN1C2=CC(=C(C=C2)Cl)Cl)C3=CC=CS3

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC(=NN1C2=CC(=C(C=C2)Cl)Cl)C3=CC=CS3

InChI

InChI=1S/C18H18Cl2N4OS/c1-23(2)8-7-21-18(25)16-11-15(17-4-3-9-26-17)22-24(16)12-5-6-13(19)14(20)10-12/h3-6,9-11H,7-8H2,1-2H3,(H,21,25)/p+1