N-[3-[[6-(cyclopropylamino)purin-9-yl]methyl]phenyl]methanamide

Systemtic Name: N-[3-[[6-(cyclopropylamino)purin-9-yl]methyl]phenyl]methanamide Openeye Name: N-[3-[[6-(cyclopropylamino)purin-9-yl]methyl]phenyl]formamide CAS Name: N-[3-[[6-(cyclopropylamino)-9-purinyl]methyl]phenyl]formamide IUPAC Name: N-[3-[[6-(cyclopropylamino)purin-9-yl]methyl]phenyl]formamide Traditional Name: N-[3-[[6-(cyclopropylamino)purin-9-yl]methyl]phenyl]formamide Formula: C16H16N6O MolecularWeight: 308.33784

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC=NC3=C2N=CN3CC4=CC(=CC=C4)NC=O

Isomeric SMILES

C1CC1NC2=NC=NC3=C2N=CN3CC4=CC(=CC=C4)NC=O

InChI

InChI=1S/C16H16N6O/c23-10-20-13-3-1-2-11(6-13)7-22-9-19-14-15(21-12-4-5-12)17-8-18-16(14)22/h1-3,6,8-10,12H,4-5,7H2,(H,20,23)(H,17,18,21)