N-[1-(1-adamantyl)butyl]-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide

Systemtic Name: N-[1-(1-adamantyl)butyl]-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide Openeye Name: N-[1-(1-adamantyl)butyl]-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide CAS Name: N-[1-(1-adamantyl)butyl]-3,5-dimethyl-1-phenyl-4-pyrazolesulfonamide IUPAC Name: N-[1-(1-adamantyl)butyl]-3,5-dimethyl-1-phenylpyrazole-4-sulfonamide Traditional Name: N-[1-(1-adamantyl)butyl]-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide Formula: C25H35N3O2S MolecularWeight: 441.6293

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C12CC3CC(C1)CC(C3)C2)NS(=O)(=O)C4=C(N(N=C4C)C5=CC=CC=C5)C

Isomeric SMILES

CCCC(C12CC3CC(C1)CC(C3)C2)NS(=O)(=O)C4=C(N(N=C4C)C5=CC=CC=C5)C

InChI

InChI=1S/C25H35N3O2S/c1-4-8-23(25-14-19-11-20(15-25)13-21(12-19)16-25)27-31(29,30)24-17(2)26-28(18(24)3)22-9-6-5-7-10-22/h5-7,9-10,19-21,23,27H,4,8,11-16H2,1-3H3