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

Systemtic Name: 1-[[1-(4-bromanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-(2-methylphenyl)urea Openeye Name: 1-[[1-(4-bromo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-(o-tolyl)urea CAS Name: 1-[[1-(4-bromo-3-methylphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-3-(2-methylphenyl)urea IUPAC Name: 1-[[1-(4-bromo-3-methylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-3-(2-methylphenyl)urea Traditional Name: 1-[[1-(4-bromo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-(o-tolyl)urea Formula: C22H23BrN4O MolecularWeight: 439.34822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NN=CC2=C(N(C(=C2)C)C3=CC(=C(C=C3)Br)C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NN=CC2=C(N(C(=C2)C)C3=CC(=C(C=C3)Br)C)C

InChI

InChI=1S/C22H23BrN4O/c1-14-7-5-6-8-21(14)25-22(28)26-24-13-18-12-16(3)27(17(18)4)19-9-10-20(23)15(2)11-19/h5-13H,1-4H3,(H2,25,26,28)