4-chloranyl-N-[1-(4-chloranyl-1H-pyrazol-5-yl)ethyl]-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[1-(4-chloranyl-1H-pyrazol-5-yl)ethyl]-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide Openeye Name: 4-chloro-N-[1-(4-chloro-1H-pyrazol-5-yl)ethyl]-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: 4-chloro-N-[1-(4-chloro-1H-pyrazol-5-yl)ethyl]-N-(2-oxo-3-azepanyl)benzenesulfonamide IUPAC Name: 4-chloro-N-[1-(4-chloro-1H-pyrazol-5-yl)ethyl]-N-(2-oxoazepan-3-yl)benzenesulfonamide Traditional Name: 4-chloro-N-[1-(4-chloro-1H-pyrazol-5-yl)ethyl]-N-(2-ketoazepan-3-yl)benzenesulfonamide Formula: C17H20Cl2N4O3S MolecularWeight: 431.3367

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=NN1)Cl)N(C2CCCCNC2=O)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C1=C(C=NN1)Cl)N(C2CCCCNC2=O)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H20Cl2N4O3S/c1-11(16-14(19)10-21-22-16)23(15-4-2-3-9-20-17(15)24)27(25,26)13-7-5-12(18)6-8-13/h5-8,10-11,15H,2-4,9H2,1H3,(H,20,24)(H,21,22)