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

Systemtic Name: N,N-dimethyl-3,4-bis(oxidanyl)-5-[6-(pentan-3-ylamino)purin-9-yl]oxolane-2-carboxamide Openeye Name: 5-[6-(1-ethylpropylamino)purin-9-yl]-3,4-dihydroxy-N,N-dimethyl-tetrahydrofuran-2-carboxamide CAS Name: 3,4-dihydroxy-N,N-dimethyl-5-[6-(pentan-3-ylamino)-9-purinyl]-2-oxolanecarboxamide IUPAC Name: 3,4-dihydroxy-N,N-dimethyl-5-[6-(pentan-3-ylamino)purin-9-yl]oxolane-2-carboxamide Traditional Name: 5-[6-(1-ethylpropylamino)purin-9-yl]-3,4-dihydroxy-N,N-dimethyl-tetrahydrofuran-2-carboxamide Formula: C17H26N6O4 MolecularWeight: 378.42614

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=NC=NC2=C1N=CN2C3C(C(C(O3)C(=O)N(C)C)O)O

Isomeric SMILES

CCC(CC)NC1=NC=NC2=C1N=CN2C3C(C(C(O3)C(=O)N(C)C)O)O

InChI

InChI=1S/C17H26N6O4/c1-5-9(6-2)21-14-10-15(19-7-18-14)23(8-20-10)17-12(25)11(24)13(27-17)16(26)22(3)4/h7-9,11-13,17,24-25H,5-6H2,1-4H3,(H,18,19,21)