9-[(4aR,6R,7R,7aR)-7-methoxy-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-8-(4-methoxyphenyl)sulfanyl-purin-6-amine

Systemtic Name: 9-[(4aR,6R,7R,7aR)-7-methoxy-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-8-(4-methoxyphenyl)sulfanyl-purin-6-amine Openeye Name: 9-[(4aR,6R,7R,7aR)-2-hydroxy-7-methoxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-8-(4-methoxyphenyl)sulfanyl-purin-6-amine CAS Name: 9-[(4aR,6R,7R,7aR)-2-hydroxy-7-methoxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-8-[(4-methoxyphenyl)thio]-6-purinamine IUPAC Name: 9-[(4aR,6R,7R,7aR)-2-hydroxy-7-methoxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-8-(4-methoxyphenyl)sulfanylpurin-6-amine Traditional Name: [9-[(4aR,6R,7R,7aR)-2-hydroxy-2-keto-7-methoxy-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-8-[(4-methoxyphenyl)thio]purin-6-yl]amine Formula: C18H20N5O7PS MolecularWeight: 481.419461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1C2C(COP(=O)(O2)O)OC1N3C4=C(C(=NC=N4)N)N=C3SC5=CC=C(C=C5)OC

Isomeric SMILES

CO[C@@H]1[C@H]2[C@@H](COP(=O)(O2)O)O[C@H]1N3C4=C(C(=NC=N4)N)N=C3SC5=CC=C(C=C5)OC

InChI

InChI=1S/C18H20N5O7PS/c1-26-9-3-5-10(6-4-9)32-18-22-12-15(19)20-8-21-16(12)23(18)17-14(27-2)13-11(29-17)7-28-31(24,25)30-13/h3-6,8,11,13-14,17H,7H2,1-2H3,(H,24,25)(H2,19,20,21)/t11-,13-,14-,17-/m1/s1