[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-[4-(2,5-dimethylpyrrol-1-yl)phenyl]methanone

Systemtic Name: [4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-[4-(2,5-dimethylpyrrol-1-yl)phenyl]methanone Openeye Name: [4-(4-bromo-3-methyl-phenyl)sulfonylpiperazin-1-yl]-[4-(2,5-dimethylpyrrol-1-yl)phenyl]methanone CAS Name: [4-(4-bromo-3-methylphenyl)sulfonyl-1-piperazinyl]-[4-(2,5-dimethyl-1-pyrrolyl)phenyl]methanone IUPAC Name: [4-(4-bromo-3-methylphenyl)sulfonylpiperazin-1-yl]-[4-(2,5-dimethylpyrrol-1-yl)phenyl]methanone Traditional Name: [4-(4-bromo-3-methyl-phenyl)sulfonylpiperazino]-[4-(2,5-dimethylpyrrol-1-yl)phenyl]methanone Formula: C24H26BrN3O3S MolecularWeight: 516.45054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)Br)C)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)Br)C)C

InChI

InChI=1S/C24H26BrN3O3S/c1-17-16-22(10-11-23(17)25)32(30,31)27-14-12-26(13-15-27)24(29)20-6-8-21(9-7-20)28-18(2)4-5-19(28)3/h4-11,16H,12-15H2,1-3H3