9-(phenylmethyl)-6-(1,2,4-triazol-4-yl)purine

Systemtic Name: 9-(phenylmethyl)-6-(1,2,4-triazol-4-yl)purine Openeye Name: 9-benzyl-6-(1,2,4-triazol-4-yl)purine CAS Name: 9-(phenylmethyl)-6-(1,2,4-triazol-4-yl)purine IUPAC Name: 9-benzyl-6-(1,2,4-triazol-4-yl)purine Traditional Name: 9-benzyl-6-(1,2,4-triazol-4-yl)purine Formula: C14H11N7 MolecularWeight: 277.28404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3N4C=NN=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3N4C=NN=C4

InChI

InChI=1S/C14H11N7/c1-2-4-11(5-3-1)6-20-8-17-12-13(20)15-7-16-14(12)21-9-18-19-10-21/h1-5,7-10H,6H2