(1E)-1-[azanyl(azepan-1-yl)methylidene]-3-(2-bromanyl-6-methyl-phenyl)urea

Systemtic Name: (1E)-1-[azanyl(azepan-1-yl)methylidene]-3-(2-bromanyl-6-methyl-phenyl)urea Openeye Name: (1E)-1-[amino(azepan-1-yl)methylene]-3-(2-bromo-6-methyl-phenyl)urea CAS Name: (1E)-1-[amino(1-azepanyl)methylidene]-3-(2-bromo-6-methylphenyl)urea IUPAC Name: (1E)-1-[amino(azepan-1-yl)methylidene]-3-(2-bromo-6-methylphenyl)urea Traditional Name: (1E)-1-[amino(azepan-1-yl)methylene]-3-(2-bromo-6-methyl-phenyl)urea Formula: C15H21BrN4O MolecularWeight: 353.25744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Br)NC(=O)N=C(N)N2CCCCCC2

Isomeric SMILES

CC1=C(C(=CC=C1)Br)NC(=O)/N=C(\N)/N2CCCCCC2

InChI

InChI=1S/C15H21BrN4O/c1-11-7-6-8-12(16)13(11)18-15(21)19-14(17)20-9-4-2-3-5-10-20/h6-8H,2-5,9-10H2,1H3,(H3,17,18,19,21)