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

Systemtic Name: 1-[4-bromanyl-2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-3-(4-propan-2-ylphenyl)urea Openeye Name: 1-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-3-(4-isopropylphenyl)urea CAS Name: 1-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-3-(4-propan-2-ylphenyl)urea IUPAC Name: 1-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-3-(4-propan-2-ylphenyl)urea Traditional Name: 1-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-3-p-cumenyl-urea Formula: C17H17BrN6O MolecularWeight: 401.26048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)NC2=C(C=C(C=C2)Br)C3=NNN=N3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)NC2=C(C=C(C=C2)Br)C3=NNN=N3

InChI

InChI=1S/C17H17BrN6O/c1-10(2)11-3-6-13(7-4-11)19-17(25)20-15-8-5-12(18)9-14(15)16-21-23-24-22-16/h3-10H,1-2H3,(H2,19,20,25)(H,21,22,23,24)