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

Systemtic Name: N-[1-(1-adamantyl)pyrazol-3-yl]-4-ethoxy-benzenesulfonamide Openeye Name: N-[1-(1-adamantyl)pyrazol-3-yl]-4-ethoxy-benzenesulfonamide CAS Name: N-[1-(1-adamantyl)-3-pyrazolyl]-4-ethoxybenzenesulfonamide IUPAC Name: N-[1-(1-adamantyl)pyrazol-3-yl]-4-ethoxybenzenesulfonamide Traditional Name: N-[1-(1-adamantyl)pyrazol-3-yl]-4-ethoxy-benzenesulfonamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=NN(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=NN(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H27N3O3S/c1-2-27-18-3-5-19(6-4-18)28(25,26)23-20-7-8-24(22-20)21-12-15-9-16(13-21)11-17(10-15)14-21/h3-8,15-17H,2,9-14H2,1H3,(H,22,23)