N-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methyl]-2,4,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methyl]-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[[1-[(4-chlorophenyl)methyl]-2-pyrrolyl]methyl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methyl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[[1-(4-chlorobenzyl)pyrrol-2-yl]methyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C21H23ClN2O2S MolecularWeight: 402.93752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCC2=CC=CN2CC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCC2=CC=CN2CC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H23ClN2O2S/c1-15-11-16(2)21(17(3)12-15)27(25,26)23-13-20-5-4-10-24(20)14-18-6-8-19(22)9-7-18/h4-12,23H,13-14H2,1-3H3