N-[4-[1-[5-(4-chlorophenyl)carbonyl-4-methyl-1H-pyrrol-2-yl]ethyl]phenyl]-2-oxidanyl-ethanesulfonamide

Systemtic Name: N-[4-[1-[5-(4-chlorophenyl)carbonyl-4-methyl-1H-pyrrol-2-yl]ethyl]phenyl]-2-oxidanyl-ethanesulfonamide Openeye Name: N-[4-[1-[5-(4-chlorobenzoyl)-4-methyl-1H-pyrrol-2-yl]ethyl]phenyl]-2-hydroxy-ethanesulfonamide CAS Name: N-[4-[1-[5-[(4-chlorophenyl)-oxomethyl]-4-methyl-1H-pyrrol-2-yl]ethyl]phenyl]-2-hydroxyethanesulfonamide IUPAC Name: N-[4-[1-[5-(4-chlorobenzoyl)-4-methyl-1H-pyrrol-2-yl]ethyl]phenyl]-2-hydroxyethanesulfonamide Traditional Name: N-[4-[1-[5-(4-chlorobenzoyl)-4-methyl-1H-pyrrol-2-yl]ethyl]phenyl]-2-hydroxy-ethanesulfonamide Formula: C22H23ClN2O4S MolecularWeight: 446.94702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1)C(C)C2=CC=C(C=C2)NS(=O)(=O)CCO)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(NC(=C1)C(C)C2=CC=C(C=C2)NS(=O)(=O)CCO)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H23ClN2O4S/c1-14-13-20(24-21(14)22(27)17-3-7-18(23)8-4-17)15(2)16-5-9-19(10-6-16)25-30(28,29)12-11-26/h3-10,13,15,24-26H,11-12H2,1-2H3