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

Systemtic Name: 1-[4-bromanyl-2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-3-(4-ethoxyphenyl)urea Openeye Name: 1-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-3-(4-ethoxyphenyl)urea CAS Name: 1-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-3-(4-ethoxyphenyl)urea IUPAC Name: 1-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-3-(4-ethoxyphenyl)urea Traditional Name: 1-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-3-p-phenetyl-urea Formula: C16H15BrN6O2 MolecularWeight: 403.2333

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)NC2=C(C=C(C=C2)Br)C3=NNN=N3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)NC2=C(C=C(C=C2)Br)C3=NNN=N3

InChI

InChI=1S/C16H15BrN6O2/c1-2-25-12-6-4-11(5-7-12)18-16(24)19-14-8-3-10(17)9-13(14)15-20-22-23-21-15/h3-9H,2H2,1H3,(H2,18,19,24)(H,20,21,22,23)