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

Systemtic Name: [3-bromanyl-4-[[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]methyl]phenyl]methanesulfonamide Openeye Name: [3-bromo-4-[[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]methyl]phenyl]methanesulfonamide CAS Name: [3-bromo-4-[[1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolyl]methyl]phenyl]methanesulfonamide IUPAC Name: [3-bromo-4-[[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]methyl]phenyl]methanesulfonamide Traditional Name: [3-bromo-4-[(1-methyl-5-p-toluoyl-pyrrol-2-yl)methyl]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(N2C)CC3=C(C=C(C=C3)CS(=O)(=O)N)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC3=C(C=C(C=C3)CS(=O)(=O)N)Br

InChI

InChI=1S/C21H21BrN2O3S/c1-14-3-6-16(7-4-14)21(25)20-10-9-18(24(20)2)12-17-8-5-15(11-19(17)22)13-28(23,26)27/h3-11H,12-13H2,1-2H3,(H2,23,26,27)