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(3S)-3-(7H-purin-6-ylamino)-3H-2-benzofuran-1-one

(3S)-3-(7H-purin-6-ylamino)-3H-2-benzofuran-1-one

Systemtic Name:(3S)-3-(7H-purin-6-ylamino)-3H-2-benzofuran-1-one
Openeye Name:(3S)-3-(7H-purin-6-ylamino)-3H-isobenzofuran-1-one
CAS Name:(3S)-3-(7H-purin-6-ylamino)-3H-isobenzofuran-1-one
IUPAC Name:(3S)-3-(7H-purin-6-ylamino)-3H-2-benzofuran-1-one
Traditional Name:(3S)-3-(7H-purin-6-ylamino)phthalide
Formula: C13H9N5O2
MolecularWeight: 267.24286
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(OC2=O)NC3=NC=NC4=C3NC=N4


Isomeric SMILES

C1=CC=C2C(=C1)[C@H](OC2=O)NC3=NC=NC4=C3NC=N4


InChI

InChI=1S/C13H9N5O2/c19-13-8-4-2-1-3-7(8)12(20-13)18-11-9-10(15-5-14-9)16-6-17-11/h1-6,12H,(H2,14,15,16,17,18)/t12-/m0/s1


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