3-[(1-adamantylcarbonylamino)carbamoyl]-N-(4-ethoxyphenyl)benzenesulfonamide

Systemtic Name: 3-[(1-adamantylcarbonylamino)carbamoyl]-N-(4-ethoxyphenyl)benzenesulfonamide Openeye Name: 3-[(adamantane-1-carbonylamino)carbamoyl]-N-(4-ethoxyphenyl)benzenesulfonamide CAS Name: 3-[[[1-adamantyl(oxo)methyl]hydrazo]-oxomethyl]-N-(4-ethoxyphenyl)benzenesulfonamide IUPAC Name: 3-[(adamantane-1-carbonylamino)carbamoyl]-N-(4-ethoxyphenyl)benzenesulfonamide Traditional Name: 3-[(adamantane-1-carbonylamino)carbamoyl]-N-p-phenetyl-benzenesulfonamide Formula: C26H31N3O5S MolecularWeight: 497.60644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H31N3O5S/c1-2-34-22-8-6-21(7-9-22)29-35(32,33)23-5-3-4-20(13-23)24(30)27-28-25(31)26-14-17-10-18(15-26)12-19(11-17)16-26/h3-9,13,17-19,29H,2,10-12,14-16H2,1H3,(H,27,30)(H,28,31)