4-chloranyl-2,5-dimethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-2,5-dimethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]benzenesulfonamide Openeye Name: 4-chloro-2,5-dimethyl-N-[1-(1-naphthylmethyl)pyrazol-3-yl]benzenesulfonamide CAS Name: 4-chloro-2,5-dimethyl-N-[1-(1-naphthalenylmethyl)-3-pyrazolyl]benzenesulfonamide IUPAC Name: 4-chloro-2,5-dimethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]benzenesulfonamide Traditional Name: 4-chloro-2,5-dimethyl-N-[1-(1-naphthylmethyl)pyrazol-3-yl]benzenesulfonamide Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NC2=NN(C=C2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NC2=NN(C=C2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H20ClN3O2S/c1-15-13-21(16(2)12-20(15)23)29(27,28)25-22-10-11-26(24-22)14-18-8-5-7-17-6-3-4-9-19(17)18/h3-13H,14H2,1-2H3,(H,24,25)