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-ethylsulfanyl-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-ethylsulfanyl-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-ethylsulfanyl-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-(ethylthio)-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-ethylsulfanylpurin-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-(ethylthio)purin-6-yl]amine Formula: C13H18N5O6PS MolecularWeight: 403.350681

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(N1C3C(C4C(O3)COP(=O)(O4)O)OC)N=CN=C2N

Isomeric SMILES

CCSC1=NC2=C(N1[C@H]3[C@@H]([C@H]4[C@H](O3)COP(=O)(O4)O)OC)N=CN=C2N

InChI

InChI=1S/C13H18N5O6PS/c1-3-26-13-17-7-10(14)15-5-16-11(7)18(13)12-9(21-2)8-6(23-12)4-22-25(19,20)24-8/h5-6,8-9,12H,3-4H2,1-2H3,(H,19,20)(H2,14,15,16)/t6-,8-,9-,12-/m1/s1