3-[[(3-chloranyl-1-adamantyl)carbonylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[[(3-chloranyl-1-adamantyl)carbonylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[[(3-chloroadamantane-1-carbonyl)amino]carbamoyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[[(3-chloro-1-adamantyl)-oxomethyl]hydrazo]-oxomethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[[(3-chloroadamantane-1-carbonyl)amino]carbamoyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[(3-chloroadamantane-1-carbonyl)amino]carbamoyl]-N,N-dimethyl-benzenesulfonamide Formula: C20H26ClN3O4S MolecularWeight: 439.95614

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

InChI

InChI=1S/C20H26ClN3O4S/c1-24(2)29(27,28)16-5-3-4-15(7-16)17(25)22-23-18(26)19-8-13-6-14(9-19)11-20(21,10-13)12-19/h3-5,7,13-14H,6,8-12H2,1-2H3,(H,22,25)(H,23,26)