1-[4-bromanyl-3-(3-pyridin-3-ylphenyl)-2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]urea

Systemtic Name: 1-[4-bromanyl-3-(3-pyridin-3-ylphenyl)-2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]urea Openeye Name: [4-bromo-3-[3-(3-pyridyl)phenyl]-2-(2H-tetrazol-5-yl)phenyl]urea CAS Name: [4-bromo-3-[3-(3-pyridinyl)phenyl]-2-(2H-tetrazol-5-yl)phenyl]urea IUPAC Name: [4-bromo-3-(3-pyridin-3-ylphenyl)-2-(2H-tetrazol-5-yl)phenyl]urea Traditional Name: [4-bromo-3-[3-(3-pyridyl)phenyl]-2-(2H-tetrazol-5-yl)phenyl]urea Formula: C19H14BrN7O MolecularWeight: 436.26476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=C(C=CC(=C2C3=NNN=N3)NC(=O)N)Br)C4=CN=CC=C4

Isomeric SMILES

C1=CC(=CC(=C1)C2=C(C=CC(=C2C3=NNN=N3)NC(=O)N)Br)C4=CN=CC=C4

InChI

InChI=1S/C19H14BrN7O/c20-14-6-7-15(23-19(21)28)17(18-24-26-27-25-18)16(14)12-4-1-3-11(9-12)13-5-2-8-22-10-13/h1-10H,(H3,21,23,28)(H,24,25,26,27)