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3-(cyclopropylmethyl)-7-(phenylmethyl)purine-2,6-dione

3-(cyclopropylmethyl)-7-(phenylmethyl)purine-2,6-dione

Systemtic Name:3-(cyclopropylmethyl)-7-(phenylmethyl)purine-2,6-dione
Openeye Name:7-benzyl-3-(cyclopropylmethyl)purine-2,6-dione
CAS Name:3-(cyclopropylmethyl)-7-(phenylmethyl)purine-2,6-dione
IUPAC Name:7-benzyl-3-(cyclopropylmethyl)purine-2,6-dione
Traditional Name:7-benzyl-3-(cyclopropylmethyl)xanthine
Formula: C16H16N4O2
MolecularWeight: 296.32384
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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C3=C(C(=O)NC2=O)N(C=N3)CC4=CC=CC=C4


Isomeric SMILES

C1CC1CN2C3=C(C(=O)NC2=O)N(C=N3)CC4=CC=CC=C4


InChI

InChI=1S/C16H16N4O2/c21-15-13-14(20(16(22)18-15)9-12-6-7-12)17-10-19(13)8-11-4-2-1-3-5-11/h1-5,10,12H,6-9H2,(H,18,21,22)


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