(2S,3S,4R,5R)-5-[6-azanyl-2-(pentan-3-ylamino)purin-9-yl]-N-ethyl-3,4-bis(oxidanyl)oxolane-2-carboxamide

Systemtic Name: (2S,3S,4R,5R)-5-[6-azanyl-2-(pentan-3-ylamino)purin-9-yl]-N-ethyl-3,4-bis(oxidanyl)oxolane-2-carboxamide Openeye Name: (2S,3S,4R,5R)-5-[6-amino-2-(1-ethylpropylamino)purin-9-yl]-N-ethyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide CAS Name: (2S,3S,4R,5R)-5-[6-amino-2-(pentan-3-ylamino)-9-purinyl]-N-ethyl-3,4-dihydroxy-2-oxolanecarboxamide IUPAC Name: (2S,3S,4R,5R)-5-[6-amino-2-(pentan-3-ylamino)purin-9-yl]-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide Traditional Name: (2S,3S,4R,5R)-5-[6-amino-2-(1-ethylpropylamino)purin-9-yl]-N-ethyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide Formula: C17H27N7O4 MolecularWeight: 393.44078

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)C(=O)NCC)O)O

Isomeric SMILES

CCC(CC)NC1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)C(=O)NCC)O)O

InChI

InChI=1S/C17H27N7O4/c1-4-8(5-2)21-17-22-13(18)9-14(23-17)24(7-20-9)16-11(26)10(25)12(28-16)15(27)19-6-3/h7-8,10-12,16,25-26H,4-6H2,1-3H3,(H,19,27)(H3,18,21,22,23)/t10-,11+,12-,16+/m0/s1