2-(2-azanylethyl)-7-[(3-methylphenyl)methyl]-3H-purin-6-one

Systemtic Name: 2-(2-azanylethyl)-7-[(3-methylphenyl)methyl]-3H-purin-6-one Openeye Name: 2-(2-aminoethyl)-7-(m-tolylmethyl)-3H-purin-6-one CAS Name: 2-(2-aminoethyl)-7-[(3-methylphenyl)methyl]-3H-purin-6-one IUPAC Name: 2-(2-aminoethyl)-7-[(3-methylphenyl)methyl]-3H-purin-6-one Traditional Name: 2-(2-aminoethyl)-7-(3-methylbenzyl)-3H-purin-6-one Formula: C15H17N5O MolecularWeight: 283.32838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=NC3=C2C(=O)N=C(N3)CCN

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=NC3=C2C(=O)N=C(N3)CCN

InChI

InChI=1S/C15H17N5O/c1-10-3-2-4-11(7-10)8-20-9-17-14-13(20)15(21)19-12(18-14)5-6-16/h2-4,7,9H,5-6,8,16H2,1H3,(H,18,19,21)