N-[3-bromanyl-4-[1-[5-(4-methylphenyl)carbonyl-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide

Systemtic Name: N-[3-bromanyl-4-[1-[5-(4-methylphenyl)carbonyl-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide Openeye Name: N-[3-bromo-4-[1-[5-(4-methylbenzoyl)-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide CAS Name: N-[3-bromo-4-[1-[5-[(4-methylphenyl)-oxomethyl]-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide IUPAC Name: N-[3-bromo-4-[1-[5-(4-methylbenzoyl)-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide Traditional Name: N-[3-bromo-4-[1-(5-p-toluoyl-1H-pyrrol-2-yl)ethyl]phenyl]methanesulfonamide Formula: C21H21BrN2O3S MolecularWeight: 461.37204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21BrN2O3S/c1-13-4-6-15(7-5-13)21(25)20-11-10-19(23-20)14(2)17-9-8-16(12-18(17)22)24-28(3,26)27/h4-12,14,23-24H,1-3H3