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

Systemtic Name: N-[4-[1-[5-(2,4-dimethylphenyl)carbonyl-1H-pyrrol-2-yl]ethyl]phenyl]-2-oxidanyl-ethanesulfonamide Openeye Name: N-[4-[1-[5-(2,4-dimethylbenzoyl)-1H-pyrrol-2-yl]ethyl]phenyl]-2-hydroxy-ethanesulfonamide CAS Name: N-[4-[1-[5-[(2,4-dimethylphenyl)-oxomethyl]-1H-pyrrol-2-yl]ethyl]phenyl]-2-hydroxyethanesulfonamide IUPAC Name: N-[4-[1-[5-(2,4-dimethylbenzoyl)-1H-pyrrol-2-yl]ethyl]phenyl]-2-hydroxyethanesulfonamide Traditional Name: N-[4-[1-[5-(2,4-dimethylbenzoyl)-1H-pyrrol-2-yl]ethyl]phenyl]-2-hydroxy-ethanesulfonamide Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)C2=CC=C(N2)C(C)C3=CC=C(C=C3)NS(=O)(=O)CCO)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)C2=CC=C(N2)C(C)C3=CC=C(C=C3)NS(=O)(=O)CCO)C

InChI

InChI=1S/C23H26N2O4S/c1-15-4-9-20(16(2)14-15)23(27)22-11-10-21(24-22)17(3)18-5-7-19(8-6-18)25-30(28,29)13-12-26/h4-11,14,17,24-26H,12-13H2,1-3H3