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

Systemtic Name: 4-[[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]pyrimidin-2-amine Openeye Name: 4-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]pyrimidin-2-amine CAS Name: 4-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]-2-pyrimidinamine IUPAC Name: 4-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]pyrimidin-2-amine Traditional Name: [4-[4-phenyl-3-(2H-tetrazol-5-yl)benzyl]pyrimidin-2-yl]amine Formula: C18H15N7 MolecularWeight: 329.3586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2)CC3=NC(=NC=C3)N)C4=NNN=N4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2)CC3=NC(=NC=C3)N)C4=NNN=N4

InChI

InChI=1S/C18H15N7/c19-18-20-9-8-14(21-18)10-12-6-7-15(13-4-2-1-3-5-13)16(11-12)17-22-24-25-23-17/h1-9,11H,10H2,(H2,19,20,21)(H,22,23,24,25)