1-(4-bromanyl-3-methyl-phenyl)-3-[[2,5-dimethyl-1-(3-methylphenyl)pyrrol-3-yl]methyl]urea

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-3-[[2,5-dimethyl-1-(3-methylphenyl)pyrrol-3-yl]methyl]urea Openeye Name: 1-(4-bromo-3-methyl-phenyl)-3-[[2,5-dimethyl-1-(m-tolyl)pyrrol-3-yl]methyl]urea CAS Name: 1-(4-bromo-3-methylphenyl)-3-[[2,5-dimethyl-1-(3-methylphenyl)-3-pyrrolyl]methyl]urea IUPAC Name: 1-(4-bromo-3-methylphenyl)-3-[[2,5-dimethyl-1-(3-methylphenyl)pyrrol-3-yl]methyl]urea Traditional Name: 1-(4-bromo-3-methyl-phenyl)-3-[[2,5-dimethyl-1-(m-tolyl)pyrrol-3-yl]methyl]urea Formula: C22H24BrN3O MolecularWeight: 426.34946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=C2C)CNC(=O)NC3=CC(=C(C=C3)Br)C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=C2C)CNC(=O)NC3=CC(=C(C=C3)Br)C)C

InChI

InChI=1S/C22H24BrN3O/c1-14-6-5-7-20(10-14)26-16(3)12-18(17(26)4)13-24-22(27)25-19-8-9-21(23)15(2)11-19/h5-12H,13H2,1-4H3,(H2,24,25,27)