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

Systemtic Name: 1-[3-(3-ethanoylphenyl)-2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]urea Openeye Name: [3-(3-acetylphenyl)-2-(2H-tetrazol-5-yl)phenyl]urea CAS Name: [3-(3-acetylphenyl)-2-(2H-tetrazol-5-yl)phenyl]urea IUPAC Name: [3-(3-acetylphenyl)-2-(2H-tetrazol-5-yl)phenyl]urea Traditional Name: [3-(3-acetylphenyl)-2-(2H-tetrazol-5-yl)phenyl]urea Formula: C16H14N6O2 MolecularWeight: 322.32136

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC(=C1)C2=C(C(=CC=C2)NC(=O)N)C3=NNN=N3

Isomeric SMILES

CC(=O)C1=CC=CC(=C1)C2=C(C(=CC=C2)NC(=O)N)C3=NNN=N3

InChI

InChI=1S/C16H14N6O2/c1-9(23)10-4-2-5-11(8-10)12-6-3-7-13(18-16(17)24)14(12)15-19-21-22-20-15/h2-8H,1H3,(H3,17,18,24)(H,19,20,21,22)