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

Systemtic Name: 3,4-bis(oxidanyl)-5-[6-(pentan-3-ylamino)purin-9-yl]-N-prop-2-enyl-oxolane-2-carboxamide Openeye Name: N-allyl-5-[6-(1-ethylpropylamino)purin-9-yl]-3,4-dihydroxy-tetrahydrofuran-2-carboxamide CAS Name: 3,4-dihydroxy-5-[6-(pentan-3-ylamino)-9-purinyl]-N-prop-2-enyl-2-oxolanecarboxamide IUPAC Name: 3,4-dihydroxy-5-[6-(pentan-3-ylamino)purin-9-yl]-N-prop-2-enyloxolane-2-carboxamide Traditional Name: N-allyl-5-[6-(1-ethylpropylamino)purin-9-yl]-3,4-dihydroxy-tetrahydrofuran-2-carboxamide Formula: C18H26N6O4 MolecularWeight: 390.43684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N6O4/c1-4-7-19-17(27)14-12(25)13(26)18(28-14)24-9-22-11-15(20-8-21-16(11)24)23-10(5-2)6-3/h4,8-10,12-14,18,25-26H,1,5-7H2,2-3H3,(H,19,27)(H,20,21,23)