4-[[2-(1-adamantyl)ethanoylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 4-[[2-(1-adamantyl)ethanoylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 4-[[[2-(1-adamantyl)acetyl]amino]carbamoyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[[[2-(1-adamantyl)-1-oxoethyl]hydrazo]-oxomethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[[[2-(1-adamantyl)acetyl]amino]carbamoyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[[[2-(1-adamantyl)acetyl]amino]carbamoyl]-N,N-dimethyl-benzenesulfonamide Formula: C21H29N3O4S MolecularWeight: 419.53766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H29N3O4S/c1-24(2)29(27,28)18-5-3-17(4-6-18)20(26)23-22-19(25)13-21-10-14-7-15(11-21)9-16(8-14)12-21/h3-6,14-16H,7-13H2,1-2H3,(H,22,25)(H,23,26)