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

Systemtic Name: 1-[[1-(4-bromanyl-2-fluoranyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-(2-methylphenyl)urea Openeye Name: 1-[[1-(4-bromo-2-fluoro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-(o-tolyl)urea CAS Name: 1-[[1-(4-bromo-2-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-3-(2-methylphenyl)urea IUPAC Name: 1-[[1-(4-bromo-2-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-3-(2-methylphenyl)urea Traditional Name: 1-[[1-(4-bromo-2-fluoro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-(o-tolyl)urea Formula: C21H20BrFN4O MolecularWeight: 443.312103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20BrFN4O/c1-13-6-4-5-7-19(13)25-21(28)26-24-12-16-10-14(2)27(15(16)3)20-9-8-17(22)11-18(20)23/h4-12H,1-3H3,(H2,25,26,28)