phenyl 7H-purin-6-ylsulfanylmethanoate

Systemtic Name: phenyl 7H-purin-6-ylsulfanylmethanoate Openeye Name: phenyl 7H-purin-6-ylsulfanylformate CAS Name: (7H-purin-6-ylthio)formic acid phenyl ester IUPAC Name: phenyl 7H-purin-6-ylsulfanylformate Traditional Name: (7H-purin-6-ylthio)formic acid phenyl ester Formula: C12H8N4O2S MolecularWeight: 272.28252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)SC2=NC=NC3=C2NC=N3

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)SC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C12H8N4O2S/c17-12(18-8-4-2-1-3-5-8)19-11-9-10(14-6-13-9)15-7-16-11/h1-7H,(H,13,14,15,16)