N-(1-adamantyl)-4-methyl-3-[(4-methylphenyl)sulfamoyl]benzamide

Systemtic Name: N-(1-adamantyl)-4-methyl-3-[(4-methylphenyl)sulfamoyl]benzamide Openeye Name: N-(1-adamantyl)-4-methyl-3-(p-tolylsulfamoyl)benzamide CAS Name: N-(1-adamantyl)-4-methyl-3-[(4-methylphenyl)sulfamoyl]benzamide IUPAC Name: N-(1-adamantyl)-4-methyl-3-[(4-methylphenyl)sulfamoyl]benzamide Traditional Name: N-(1-adamantyl)-4-methyl-3-(p-tolylsulfamoyl)benzamide Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NC34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NC34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C25H30N2O3S/c1-16-3-7-22(8-4-16)27-31(29,30)23-12-21(6-5-17(23)2)24(28)26-25-13-18-9-19(14-25)11-20(10-18)15-25/h3-8,12,18-20,27H,9-11,13-15H2,1-2H3,(H,26,28)