5-(6-aminopurin-9-yl)-2-[1-(5-chloranylthiophen-2-yl)propan-2-yloxymethyl]-4-methoxy-oxolan-3-ol

Systemtic Name: 5-(6-aminopurin-9-yl)-2-[1-(5-chloranylthiophen-2-yl)propan-2-yloxymethyl]-4-methoxy-oxolan-3-ol Openeye Name: 5-(6-aminopurin-9-yl)-2-[[2-(5-chloro-2-thienyl)-1-methyl-ethoxy]methyl]-4-methoxy-tetrahydrofuran-3-ol CAS Name: 5-(6-aminopurin-9-yl)-2-[1-(5-chloro-2-thiophenyl)propan-2-yloxymethyl]-4-methoxy-3-oxolanol IUPAC Name: 5-(6-aminopurin-9-yl)-2-[1-(5-chlorothiophen-2-yl)propan-2-yloxymethyl]-4-methoxyoxolan-3-ol Traditional Name: 5-adenin-9-yl-2-[[2-(5-chloro-2-thienyl)-1-methyl-ethoxy]methyl]-4-methoxy-tetrahydrofuran-3-ol Formula: C18H22ClN5O4S MolecularWeight: 439.91638

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(S1)Cl)OCC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)OC)O

Isomeric SMILES

CC(CC1=CC=C(S1)Cl)OCC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)OC)O

InChI

InChI=1S/C18H22ClN5O4S/c1-9(5-10-3-4-12(19)29-10)27-6-11-14(25)15(26-2)18(28-11)24-8-23-13-16(20)21-7-22-17(13)24/h3-4,7-9,11,14-15,18,25H,5-6H2,1-2H3,(H2,20,21,22)