N-(2-adamantyl)-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide

Systemtic Name: N-(2-adamantyl)-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide Openeye Name: N-(2-adamantyl)-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide CAS Name: N-(2-adamantyl)-3,5-dimethyl-1-phenyl-4-pyrazolesulfonamide IUPAC Name: N-(2-adamantyl)-3,5-dimethyl-1-phenylpyrazole-4-sulfonamide Traditional Name: N-(2-adamantyl)-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)NC3C4CC5CC(C4)CC3C5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)NC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C21H27N3O2S/c1-13-21(14(2)24(22-13)19-6-4-3-5-7-19)27(25,26)23-20-17-9-15-8-16(11-17)12-18(20)10-15/h3-7,15-18,20,23H,8-12H2,1-2H3