N-[3-[(1-methyl-6-oxidanylidene-purin-9-yl)methyl]phenyl]methanamide

Systemtic Name: N-[3-[(1-methyl-6-oxidanylidene-purin-9-yl)methyl]phenyl]methanamide Openeye Name: N-[3-[(1-methyl-6-oxo-purin-9-yl)methyl]phenyl]formamide CAS Name: N-[3-[(1-methyl-6-oxo-9-purinyl)methyl]phenyl]formamide IUPAC Name: N-[3-[(1-methyl-6-oxopurin-9-yl)methyl]phenyl]formamide Traditional Name: N-[3-[(6-keto-1-methyl-purin-9-yl)methyl]phenyl]formamide Formula: C14H13N5O2 MolecularWeight: 283.28532

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C(C1=O)N=CN2CC3=CC(=CC=C3)NC=O

Isomeric SMILES

CN1C=NC2=C(C1=O)N=CN2CC3=CC(=CC=C3)NC=O

InChI

InChI=1S/C14H13N5O2/c1-18-7-16-13-12(14(18)21)15-8-19(13)6-10-3-2-4-11(5-10)17-9-20/h2-5,7-9H,6H2,1H3,(H,17,20)