3-[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]-1,1-dimethyl-urea

Systemtic Name: 3-[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]-1,1-dimethyl-urea Openeye Name: 3-[3-(4-bromo-1-methyl-pyrazol-3-yl)phenyl]-1,1-dimethyl-urea CAS Name: 3-[3-(4-bromo-1-methyl-3-pyrazolyl)phenyl]-1,1-dimethylurea IUPAC Name: 3-[3-(4-bromo-1-methylpyrazol-3-yl)phenyl]-1,1-dimethylurea Traditional Name: 3-[3-(4-bromo-1-methyl-pyrazol-3-yl)phenyl]-1,1-dimethyl-urea Formula: C13H15BrN4O MolecularWeight: 323.1884

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC(=CC=C2)NC(=O)N(C)C)Br

Isomeric SMILES

CN1C=C(C(=N1)C2=CC(=CC=C2)NC(=O)N(C)C)Br

InChI

InChI=1S/C13H15BrN4O/c1-17(2)13(19)15-10-6-4-5-9(7-10)12-11(14)8-18(3)16-12/h4-8H,1-3H3,(H,15,19)