6-[(4-nitrophenyl)methylsulfanyl]-9-(oxolan-2-yl)purine

Systemtic Name: 6-[(4-nitrophenyl)methylsulfanyl]-9-(oxolan-2-yl)purine Openeye Name: 6-[(4-nitrophenyl)methylsulfanyl]-9-tetrahydrofuran-2-yl-purine CAS Name: 6-[(4-nitrophenyl)methylthio]-9-(2-oxolanyl)purine IUPAC Name: 6-[(4-nitrophenyl)methylsulfanyl]-9-(oxolan-2-yl)purine Traditional Name: 6-[(4-nitrobenzyl)thio]-9-(tetrahydrofuryl)purine Formula: C16H15N5O3S MolecularWeight: 357.387

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)N2C=NC3=C2N=CN=C3SCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)N2C=NC3=C2N=CN=C3SCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O3S/c22-21(23)12-5-3-11(4-6-12)8-25-16-14-15(17-9-18-16)20(10-19-14)13-2-1-7-24-13/h3-6,9-10,13H,1-2,7-8H2