N-[(2R)-3-(1-adamantylamino)-2-oxidanyl-propyl]-N-(4-methylphenyl)benzenesulfonamide

Systemtic Name: N-[(2R)-3-(1-adamantylamino)-2-oxidanyl-propyl]-N-(4-methylphenyl)benzenesulfonamide Openeye Name: N-[(2R)-3-(1-adamantylamino)-2-hydroxy-propyl]-N-(p-tolyl)benzenesulfonamide CAS Name: N-[(2R)-3-(1-adamantylamino)-2-hydroxypropyl]-N-(4-methylphenyl)benzenesulfonamide IUPAC Name: N-[(2R)-3-(1-adamantylamino)-2-hydroxypropyl]-N-(4-methylphenyl)benzenesulfonamide Traditional Name: N-[(2R)-3-(1-adamantylamino)-2-hydroxy-propyl]-N-(p-tolyl)benzenesulfonamide Formula: C26H34N2O3S MolecularWeight: 454.62476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC(CNC23CC4CC(C2)CC(C4)C3)O)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N(C[C@@H](CNC23CC4CC(C2)CC(C4)C3)O)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H34N2O3S/c1-19-7-9-23(10-8-19)28(32(30,31)25-5-3-2-4-6-25)18-24(29)17-27-26-14-20-11-21(15-26)13-22(12-20)16-26/h2-10,20-22,24,27,29H,11-18H2,1H3/t20?,21?,22?,24-,26?/m1/s1