N-[1-(1-adamantyl)pyrazol-3-yl]-4-propyl-benzenesulfonamide

Systemtic Name: N-[1-(1-adamantyl)pyrazol-3-yl]-4-propyl-benzenesulfonamide Openeye Name: N-[1-(1-adamantyl)pyrazol-3-yl]-4-propyl-benzenesulfonamide CAS Name: N-[1-(1-adamantyl)-3-pyrazolyl]-4-propylbenzenesulfonamide IUPAC Name: N-[1-(1-adamantyl)pyrazol-3-yl]-4-propylbenzenesulfonamide Traditional Name: N-[1-(1-adamantyl)pyrazol-3-yl]-4-propyl-benzenesulfonamide Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=NN(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=NN(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H29N3O2S/c1-2-3-16-4-6-20(7-5-16)28(26,27)24-21-8-9-25(23-21)22-13-17-10-18(14-22)12-19(11-17)15-22/h4-9,17-19H,2-3,10-15H2,1H3,(H,23,24)