5-[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]-4-phenyl-pyrimidin-2-amine

Systemtic Name: 5-[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]-4-phenyl-pyrimidin-2-amine Openeye Name: 5-[1-(4-bromophenyl)tetrazol-5-yl]-4-phenyl-pyrimidin-2-amine CAS Name: 5-[1-(4-bromophenyl)-5-tetrazolyl]-4-phenyl-2-pyrimidinamine IUPAC Name: 5-[1-(4-bromophenyl)tetrazol-5-yl]-4-phenylpyrimidin-2-amine Traditional Name: [5-[1-(4-bromophenyl)tetrazol-5-yl]-4-phenyl-pyrimidin-2-yl]amine Formula: C17H12BrN7 MolecularWeight: 394.22808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC=C2C3=NN=NN3C4=CC=C(C=C4)Br)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC=C2C3=NN=NN3C4=CC=C(C=C4)Br)N

InChI

InChI=1S/C17H12BrN7/c18-12-6-8-13(9-7-12)25-16(22-23-24-25)14-10-20-17(19)21-15(14)11-4-2-1-3-5-11/h1-10H,(H2,19,20,21)