N-[[2-(1,2,4-triazol-1-yl)phenyl]methyl]-7H-purin-6-amine

Systemtic Name: N-[[2-(1,2,4-triazol-1-yl)phenyl]methyl]-7H-purin-6-amine Openeye Name: N-[[2-(1,2,4-triazol-1-yl)phenyl]methyl]-7H-purin-6-amine CAS Name: N-[[2-(1,2,4-triazol-1-yl)phenyl]methyl]-7H-purin-6-amine IUPAC Name: N-[[2-(1,2,4-triazol-1-yl)phenyl]methyl]-7H-purin-6-amine Traditional Name: 7H-purin-6-yl-[2-(1,2,4-triazol-1-yl)benzyl]amine Formula: C14H12N8 MolecularWeight: 292.29868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=NC=NC3=C2NC=N3)N4C=NC=N4

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=NC=NC3=C2NC=N3)N4C=NC=N4

InChI

InChI=1S/C14H12N8/c1-2-4-11(22-9-15-6-21-22)10(3-1)5-16-13-12-14(18-7-17-12)20-8-19-13/h1-4,6-9H,5H2,(H2,16,17,18,19,20)