6-(aziridin-1-yl)-8-chloranyl-9-(phenylmethyl)purine

Systemtic Name: 6-(aziridin-1-yl)-8-chloranyl-9-(phenylmethyl)purine Openeye Name: 6-(aziridin-1-yl)-9-benzyl-8-chloro-purine CAS Name: 6-(1-aziridinyl)-8-chloro-9-(phenylmethyl)purine IUPAC Name: 6-(aziridin-1-yl)-9-benzyl-8-chloropurine Traditional Name: 9-benzyl-8-chloro-6-ethylenimino-purine Formula: C14H12ClN5 MolecularWeight: 285.73158

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1C2=NC=NC3=C2N=C(N3CC4=CC=CC=C4)Cl

Isomeric SMILES

C1CN1C2=NC=NC3=C2N=C(N3CC4=CC=CC=C4)Cl

InChI

InChI=1S/C14H12ClN5/c15-14-18-11-12(19-6-7-19)16-9-17-13(11)20(14)8-10-4-2-1-3-5-10/h1-5,9H,6-8H2