3,4-bis(chloranyl)-N-[2-ethyl-1-(2-phenylpyrazol-3-yl)butyl]benzenesulfonamide

Systemtic Name: 3,4-bis(chloranyl)-N-[2-ethyl-1-(2-phenylpyrazol-3-yl)butyl]benzenesulfonamide Openeye Name: 3,4-dichloro-N-[2-ethyl-1-(2-phenylpyrazol-3-yl)butyl]benzenesulfonamide CAS Name: 3,4-dichloro-N-[2-ethyl-1-(2-phenyl-3-pyrazolyl)butyl]benzenesulfonamide IUPAC Name: 3,4-dichloro-N-[2-ethyl-1-(2-phenylpyrazol-3-yl)butyl]benzenesulfonamide Traditional Name: 3,4-dichloro-N-[2-ethyl-1-(2-phenylpyrazol-3-yl)butyl]benzenesulfonamide Formula: C21H23Cl2N3O2S MolecularWeight: 452.39722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C1=CC=NN1C2=CC=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCC(CC)C(C1=CC=NN1C2=CC=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H23Cl2N3O2S/c1-3-15(4-2)21(20-12-13-24-26(20)16-8-6-5-7-9-16)25-29(27,28)17-10-11-18(22)19(23)14-17/h5-15,21,25H,3-4H2,1-2H3