(2R)-2-(1-adamantylamino)-N-[3-(dimethylsulfamoyl)phenyl]propanamide

Systemtic Name: (2R)-2-(1-adamantylamino)-N-[3-(dimethylsulfamoyl)phenyl]propanamide Openeye Name: (2R)-2-(1-adamantylamino)-N-[3-(dimethylsulfamoyl)phenyl]propanamide CAS Name: (2R)-2-(1-adamantylamino)-N-[3-(dimethylsulfamoyl)phenyl]propanamide IUPAC Name: (2R)-2-(1-adamantylamino)-N-[3-(dimethylsulfamoyl)phenyl]propanamide Traditional Name: (2R)-2-(1-adamantylamino)-N-[3-(dimethylsulfamoyl)phenyl]propionamide Formula: C21H31N3O3S MolecularWeight: 405.55414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N(C)C)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=CC=C1)S(=O)(=O)N(C)C)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H31N3O3S/c1-14(23-21-11-15-7-16(12-21)9-17(8-15)13-21)20(25)22-18-5-4-6-19(10-18)28(26,27)24(2)3/h4-6,10,14-17,23H,7-9,11-13H2,1-3H3,(H,22,25)/t14-,15?,16?,17?,21?/m1/s1