N-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-propan-2-yl-benzenesulfonamide

Systemtic Name: N-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-propan-2-yl-benzenesulfonamide Openeye Name: N-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-isopropyl-benzenesulfonamide CAS Name: N-[[1-[(4-chlorophenyl)methyl]-2-pyrrolyl]methyl]-4-propan-2-ylbenzenesulfonamide IUPAC Name: N-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-propan-2-ylbenzenesulfonamide Traditional Name: N-[[1-(4-chlorobenzyl)pyrrol-2-yl]methyl]-4-isopropyl-benzenesulfonamide Formula: C21H23ClN2O2S MolecularWeight: 402.93752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CN2CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CN2CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN2O2S/c1-16(2)18-7-11-21(12-8-18)27(25,26)23-14-20-4-3-13-24(20)15-17-5-9-19(22)10-6-17/h3-13,16,23H,14-15H2,1-2H3