3-[[2-(1-adamantyl)ethanoylamino]carbamoyl]-4-chloranyl-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[[2-(1-adamantyl)ethanoylamino]carbamoyl]-4-chloranyl-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[[[2-(1-adamantyl)acetyl]amino]carbamoyl]-4-chloro-N,N-diethyl-benzenesulfonamide CAS Name: 3-[[[2-(1-adamantyl)-1-oxoethyl]hydrazo]-oxomethyl]-4-chloro-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[[[2-(1-adamantyl)acetyl]amino]carbamoyl]-4-chloro-N,N-diethylbenzenesulfonamide Traditional Name: 3-[[[2-(1-adamantyl)acetyl]amino]carbamoyl]-4-chloro-N,N-diethyl-benzenesulfonamide Formula: C23H32ClN3O4S MolecularWeight: 482.03588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32ClN3O4S/c1-3-27(4-2)32(30,31)18-5-6-20(24)19(10-18)22(29)26-25-21(28)14-23-11-15-7-16(12-23)9-17(8-15)13-23/h5-6,10,15-17H,3-4,7-9,11-14H2,1-2H3,(H,25,28)(H,26,29)