5-(6-aminopurin-9-yl)-2-[[naphthalen-2-ylmethoxy(oxidanyl)phosphinothioyl]oxymethyl]oxolan-3-ol

Systemtic Name: 5-(6-aminopurin-9-yl)-2-[[naphthalen-2-ylmethoxy(oxidanyl)phosphinothioyl]oxymethyl]oxolan-3-ol Openeye Name: 5-(6-aminopurin-9-yl)-2-[[hydroxy(2-naphthylmethoxy)phosphinothioyl]oxymethyl]tetrahydrofuran-3-ol CAS Name: 5-(6-aminopurin-9-yl)-2-[[hydroxy(2-naphthalenylmethoxy)phosphinothioyl]oxymethyl]-3-oxolanol IUPAC Name: 5-(6-aminopurin-9-yl)-2-[[hydroxy(naphthalen-2-ylmethoxy)phosphinothioyl]oxymethyl]oxolan-3-ol Traditional Name: 5-adenin-9-yl-2-[[hydroxy(2-naphthylmethoxy)thiophosphoryl]oxymethyl]tetrahydrofuran-3-ol Formula: C21H22N5O5PS MolecularWeight: 487.468641

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3N)COP(=S)(O)OCC4=CC5=CC=CC=C5C=C4)O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2N=CN=C3N)COP(=S)(O)OCC4=CC5=CC=CC=C5C=C4)O

InChI

InChI=1S/C21H22N5O5PS/c22-20-19-21(24-11-23-20)26(12-25-19)18-8-16(27)17(31-18)10-30-32(28,33)29-9-13-5-6-14-3-1-2-4-15(14)7-13/h1-7,11-12,16-18,27H,8-10H2,(H,28,33)(H2,22,23,24)