N-[2-[(6-aminopurin-9-yl)methyl]-4,5-bis(oxidanyl)oxolan-3-yl]-2-azanyl-3-phenyl-propanamide

Systemtic Name: N-[2-[(6-aminopurin-9-yl)methyl]-4,5-bis(oxidanyl)oxolan-3-yl]-2-azanyl-3-phenyl-propanamide Openeye Name: 2-amino-N-[2-[(6-aminopurin-9-yl)methyl]-4,5-dihydroxy-tetrahydrofuran-3-yl]-3-phenyl-propanamide CAS Name: 2-amino-N-[2-[(6-aminopurin-9-yl)methyl]-4,5-dihydroxy-3-oxolanyl]-3-phenylpropanamide IUPAC Name: 2-amino-N-[2-[(6-aminopurin-9-yl)methyl]-4,5-dihydroxyoxolan-3-yl]-3-phenylpropanamide Traditional Name: N-[2-(adenin-9-ylmethyl)-4,5-dihydroxy-tetrahydrofuran-3-yl]-2-amino-3-phenyl-propionamide Formula: C19H23N7O4 MolecularWeight: 413.43042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2C(OC(C2O)O)CN3C=NC4=C3N=CN=C4N)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC2C(OC(C2O)O)CN3C=NC4=C3N=CN=C4N)N

InChI

InChI=1S/C19H23N7O4/c20-11(6-10-4-2-1-3-5-10)18(28)25-13-12(30-19(29)15(13)27)7-26-9-24-14-16(21)22-8-23-17(14)26/h1-5,8-9,11-13,15,19,27,29H,6-7,20H2,(H,25,28)(H2,21,22,23)