4-chloranyl-N-[4-[4-[(4-cyanobutylamino)methyl]phenyl]cyclohexyl]-N-methyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[4-[4-[(4-cyanobutylamino)methyl]phenyl]cyclohexyl]-N-methyl-benzenesulfonamide Openeye Name: 4-chloro-N-[4-[4-[(4-cyanobutylamino)methyl]phenyl]cyclohexyl]-N-methyl-benzenesulfonamide CAS Name: 4-chloro-N-[4-[4-[(4-cyanobutylamino)methyl]phenyl]cyclohexyl]-N-methylbenzenesulfonamide IUPAC Name: 4-chloro-N-[4-[4-[(4-cyanobutylamino)methyl]phenyl]cyclohexyl]-N-methylbenzenesulfonamide Traditional Name: 4-chloro-N-[4-[4-[(4-cyanobutylamino)methyl]phenyl]cyclohexyl]-N-methyl-benzenesulfonamide Formula: C25H32ClN3O2S MolecularWeight: 474.05848

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC(CC1)C2=CC=C(C=C2)CNCCCCC#N)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C1CCC(CC1)C2=CC=C(C=C2)CNCCCCC#N)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H32ClN3O2S/c1-29(32(30,31)25-15-11-23(26)12-16-25)24-13-9-22(10-14-24)21-7-5-20(6-8-21)19-28-18-4-2-3-17-27/h5-8,11-12,15-16,22,24,28H,2-4,9-10,13-14,18-19H2,1H3