2-methyl-N-[9-[4-methyl-3,5-bis(oxidanyl)oxan-2-yl]-6-prop-2-enoxy-purin-2-yl]propanamide

Systemtic Name: 2-methyl-N-[9-[4-methyl-3,5-bis(oxidanyl)oxan-2-yl]-6-prop-2-enoxy-purin-2-yl]propanamide Openeye Name: N-[6-allyloxy-9-(3,5-dihydroxy-4-methyl-tetrahydropyran-2-yl)purin-2-yl]-2-methyl-propanamide CAS Name: N-[9-(3,5-dihydroxy-4-methyl-2-oxanyl)-6-prop-2-enoxy-2-purinyl]-2-methylpropanamide IUPAC Name: N-[9-(3,5-dihydroxy-4-methyloxan-2-yl)-6-prop-2-enoxypurin-2-yl]-2-methylpropanamide Traditional Name: N-[6-allyloxy-9-(3,5-dihydroxy-4-methyl-tetrahydropyran-2-yl)purin-2-yl]-2-methyl-propionamide Formula: C18H25N5O5 MolecularWeight: 391.4216

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(COC(C1O)N2C=NC3=C2N=C(N=C3OCC=C)NC(=O)C(C)C)O

Isomeric SMILES

CC1C(COC(C1O)N2C=NC3=C2N=C(N=C3OCC=C)NC(=O)C(C)C)O

InChI

InChI=1S/C18H25N5O5/c1-5-6-27-16-12-14(20-18(22-16)21-15(26)9(2)3)23(8-19-12)17-13(25)10(4)11(24)7-28-17/h5,8-11,13,17,24-25H,1,6-7H2,2-4H3,(H,20,21,22,26)