1-[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]urea

Systemtic Name: 1-[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]urea Openeye Name: [3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]urea CAS Name: [3-(4-bromophenyl)-1-phenyl-4-pyrazolyl]urea IUPAC Name: [3-(4-bromophenyl)-1-phenylpyrazol-4-yl]urea Traditional Name: [3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]urea Formula: C16H13BrN4O MolecularWeight: 357.20462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Br)NC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Br)NC(=O)N

InChI

InChI=1S/C16H13BrN4O/c17-12-8-6-11(7-9-12)15-14(19-16(18)22)10-21(20-15)13-4-2-1-3-5-13/h1-10H,(H3,18,19,22)