N-(1-adamantyl)-3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]benzamide

Systemtic Name: N-(1-adamantyl)-3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]benzamide Openeye Name: N-(1-adamantyl)-3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)sulfamoyl]benzamide CAS Name: N-(1-adamantyl)-3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)sulfamoyl]benzamide IUPAC Name: N-(1-adamantyl)-3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)sulfamoyl]benzamide Traditional Name: N-(1-adamantyl)-3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)sulfamoyl]benzamide Formula: C28H32N4O4S MolecularWeight: 520.64308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C28H32N4O4S/c1-18-25(27(34)32(31(18)2)23-8-4-3-5-9-23)30-37(35,36)24-10-6-7-22(14-24)26(33)29-28-15-19-11-20(16-28)13-21(12-19)17-28/h3-10,14,19-21,30H,11-13,15-17H2,1-2H3,(H,29,33)