8-(7-propylsulfanyl-2,3-dihydro-1-benzofuran-4-yl)-7H-purine

Systemtic Name: 8-(7-propylsulfanyl-2,3-dihydro-1-benzofuran-4-yl)-7H-purine Openeye Name: 8-(7-propylsulfanyl-2,3-dihydrobenzofuran-4-yl)-7H-purine CAS Name: 8-[7-(propylthio)-2,3-dihydrobenzofuran-4-yl]-7H-purine IUPAC Name: 8-(7-propylsulfanyl-2,3-dihydro-1-benzofuran-4-yl)-7H-purine Traditional Name: 8-[7-(propylthio)coumaran-4-yl]-7H-purine Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C2C(=C(C=C1)C3=NC4=NC=NC=C4N3)CCO2

Isomeric SMILES

CCCSC1=C2C(=C(C=C1)C3=NC4=NC=NC=C4N3)CCO2

InChI

InChI=1S/C16H16N4OS/c1-2-7-22-13-4-3-11(10-5-6-21-14(10)13)15-19-12-8-17-9-18-16(12)20-15/h3-4,8-9H,2,5-7H2,1H3,(H,17,18,19,20)