3-[(1-adamantylcarbonylamino)carbamoyl]-4-chloranyl-N-methyl-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 3-[(1-adamantylcarbonylamino)carbamoyl]-4-chloranyl-N-methyl-N-propan-2-yl-benzenesulfonamide Openeye Name: 3-[(adamantane-1-carbonylamino)carbamoyl]-4-chloro-N-isopropyl-N-methyl-benzenesulfonamide CAS Name: 3-[[[1-adamantyl(oxo)methyl]hydrazo]-oxomethyl]-4-chloro-N-methyl-N-propan-2-ylbenzenesulfonamide IUPAC Name: 3-[(adamantane-1-carbonylamino)carbamoyl]-4-chloro-N-methyl-N-propan-2-ylbenzenesulfonamide Traditional Name: 3-[(adamantane-1-carbonylamino)carbamoyl]-4-chloro-N-isopropyl-N-methyl-benzenesulfonamide Formula: C22H30ClN3O4S MolecularWeight: 468.0093

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30ClN3O4S/c1-13(2)26(3)31(29,30)17-4-5-19(23)18(9-17)20(27)24-25-21(28)22-10-14-6-15(11-22)8-16(7-14)12-22/h4-5,9,13-16H,6-8,10-12H2,1-3H3,(H,24,27)(H,25,28)