[(2S,5R)-5-(6-aminopurin-9-yl)-4-(2-methylphenyl)sulfanyl-2,5-dihydrofuran-2-yl]methanol

Systemtic Name: [(2S,5R)-5-(6-aminopurin-9-yl)-4-(2-methylphenyl)sulfanyl-2,5-dihydrofuran-2-yl]methanol Openeye Name: [(2S,5R)-5-(6-aminopurin-9-yl)-4-(o-tolylsulfanyl)-2,5-dihydrofuran-2-yl]methanol CAS Name: [(2S,5R)-5-(6-aminopurin-9-yl)-4-[(2-methylphenyl)thio]-2,5-dihydrofuran-2-yl]methanol IUPAC Name: [(2S,5R)-5-(6-aminopurin-9-yl)-4-(2-methylphenyl)sulfanyl-2,5-dihydrofuran-2-yl]methanol Traditional Name: [(2S,5R)-5-adenin-9-yl-4-(o-tolylthio)-2,5-dihydrofuran-2-yl]methanol Formula: C17H17N5O2S MolecularWeight: 355.41418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SC2=CC(OC2N3C=NC4=C3N=CN=C4N)CO

Isomeric SMILES

CC1=CC=CC=C1SC2=C[C@H](O[C@H]2N3C=NC4=C3N=CN=C4N)CO

InChI

InChI=1S/C17H17N5O2S/c1-10-4-2-3-5-12(10)25-13-6-11(7-23)24-17(13)22-9-21-14-15(18)19-8-20-16(14)22/h2-6,8-9,11,17,23H,7H2,1H3,(H2,18,19,20)/t11-,17+/m0/s1